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eebb5f82634b672b77e763fad1ac6c54b17384f857471be86c32a6883226b91f
[ "arxiv" ]
Structured Inference with Large Language Gibbs
The knowledge encoded in large language models (LLMs) can serve as a substrate for structured reasoning over variables describing a complex world, but accessing this knowledge in a probabilistically coherent manner poses a difficult inference problem. We propose Large Language Gibbs, a scheme for structured probabilist...
[ "Sanghyeok Choi", "Henry Gouk", "Esmeralda S. Whitammer" ]
[ "cs.LG", "cs.CL" ]
[]
2026-06-17T00:00:00
https://arxiv.org/abs/2606.19264
https://arxiv.org/pdf/2606.19264v1
2606.19264
null
0
0
true
https://github.com/hyeok9855/large-language-gibbs
null
0.65
e62eac19d405492b987241008282a6f5f4ab31ba1c081e4fa3ff8ea47c697650
[ "arxiv", "semantic_scholar" ]
Circuit Tracing in Autoregressive Protein Language Models
Protein language models (pLMs) can generate novel protein sequences with properties beyond those observed in nature, yet the mechanisms underlying protein generation remain poorly understood. Existing mechanistic interpretability methods based on sparse autoencoders and transcoders primarily focus on protein representa...
[ "Darin Tsui", "William Deinzer", "Daniel Saeedi", "Amirali Aghazadeh" ]
[ "cs.LG", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2026-06-14T00:00:00
https://arxiv.org/abs/2606.16044
https://arxiv.org/pdf/2606.16044v1
2606.16044
null
0
0
false
null
null
0.35
b4ea4f2bd4905955546c4b718c1176776c1aa0eca5c37d120f4c93bce089dd0e
[ "arxiv", "semantic_scholar" ]
Viral Proteins Reveal Geometry of Protein Language Models
Protein language models are trained on highly imbalanced datasets, raising the question of how they represent underrepresented biological sequences. Using viral proteins as a case study across ESM model families, we identify a dominant nativeness axis in embedding space, aligned with masked reconstruction perplexity, t...
[ "Arthur Bigot", "Harmon Bhasin", "Core Francisco Park", "Eugene Shakhnovich", "Dianzhuo Wang" ]
[ "cs.LG", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2026-06-10T00:00:00
https://arxiv.org/abs/2606.12609
https://arxiv.org/pdf/2606.12609v1
2606.12609
null
0
0
true
https://github.com/MisteFr/viral-proteins-plms
null
0.65
c49810ee97d0a51419cf749c4b4fa9f086d8e584ea6e8b149b965b62160da914
[ "arxiv", "semantic_scholar" ]
Interpretable enzyme function prediction via sparse autoencoder features of ESMC across the microbial protein universe
Microbial genomes and metagenomes contain millions of proteins whose enzymatic functions remain unknown, the enzyme dark matter. While deep learning has improved protein function prediction, most methods are black boxes relying on sequence or structural similarity, limiting discovery of novel catalytic activities. The ...
[ "Yue Hu", "Wanyu Cheng", "Junqing Wang", "Yingchao Liu" ]
[ "q-bio.QM" ]
[ "Biology" ]
2026-06-10T00:00:00
https://arxiv.org/abs/2606.12209
https://arxiv.org/pdf/2606.12209v1
2606.12209
null
0
0
false
null
null
0.35
11fb3a5074ccf50b67955588d254dd0415c57abf44f31d2d4a86f30758314396
[ "arxiv", "semantic_scholar" ]
The Dynamics of Human and AI-Generated Language: How Semantics Fluctuates across Different Timescales
Spoken language, whether produced by humans or large language models (LLM), unfolds over time with varying semantic content. However, we still lack simple, interpretable time-series features that capture how generic versus specific content is distributed over time, and that can be used to compare human and AI-generated...
[ "Han-Jen Chang", "Yasir Γ‡atal", "Angelika Wolman", "AgustΓ­n IbÑñez", "David Smith", "I-Wen Su", "Kai-Yuan Cheng", "Georg Northoff" ]
[ "cs.CL", "cs.AI", "eess.AS", "eess.SP" ]
[ "Computer Science", "Engineering" ]
2026-06-09T00:00:00
https://arxiv.org/abs/2606.11371
https://arxiv.org/pdf/2606.11371v1
2606.11371
10.1016/j.csl.2026.102013
0
0
false
null
Computer Speech & Language (2026) 102013
0.55
73b2733d2ce24b808a8208758c7cf16e243f584bf9eb4076327effc258f373bb
[ "arxiv", "semantic_scholar" ]
Protein Dynamics Beyond Structure Prediction
The ability to predict protein three-dimensional structures from amino acid sequences is a landmark achievement in molecular biology, where recent deep learning approaches such as AlphaFold are the culmination of decades of work. Yet, the quantitative understanding of how protein sequences give rise to dynamic conforma...
[ "Juliette GriffiΓ©", "Sviatlana Shashkova", "Antonio Ciarlo", "Sreekanth K. Manikandan", "Claes AndrΓ©asson", "Malin BΓ€ckstrΓΆm", "Tristan Bereau", "Hjalmar Brismar", "Carlos Bustamante", "Marta Carroni", "Roberto Covino", "Andreas Dahlin", "Sebastian Deindl", "Lucie Delemotte", "Arne Elofs...
[ "q-bio.BM", "cond-mat.mes-hall", "cond-mat.soft" ]
[ "Biology", "Physics" ]
2026-06-07T00:00:00
https://arxiv.org/abs/2606.08647
https://arxiv.org/pdf/2606.08647v1
2606.08647
null
0
0
false
null
null
0.35
8c80f94a1a6012d40c0562932106544a7d6f569f69e4ef60962c84aaf6c77f9e
[ "arxiv", "semantic_scholar" ]
AF_Cache: Efficient Pipeline for Running AlphaFold for High-Throughput Protein-Protein Interaction Prediction
Motivation: Accurate prediction of protein-protein interactions is essential for understanding biological processes, and recent advances such as AlphaFold2 and AlphaFold3 have enabled structure-based interaction prediction at unprecedented accuracy. However, the high computational cost of these methods, driven primaril...
[ "Sarah Narrowe", "Arne Elofsson Claudio Mirabello" ]
[ "q-bio.BM" ]
[ "Biology" ]
2026-06-03T00:00:00
https://arxiv.org/abs/2606.04566
https://arxiv.org/pdf/2606.04566v1
2606.04566
null
0
0
true
https://github.com/clami66/AF_cache
null
0.65
40e0bc6e12f212225681f7b0f972a0b20191b5b0c8b6c7a60c1372f27ea3d36d
[ "arxiv", "semantic_scholar" ]
Structure-Aware Prediction of PROTAC-Mediated Protein Degradability via Graph Neural Networks
Proteolysis-targeting chimeras (PROTACs) can selectively degrade disease-causing proteins, yet predicting which targets are amenable to degradation remains a critical bottleneck: existing computational methods require the complete PROTAC molecular structure, information unavailable before synthesis. We present DegradoM...
[ "Bryan Cheng", "Austin Jin" ]
[ "q-bio.QM", "cs.LG" ]
[ "Biology", "Computer Science" ]
2026-06-01T00:00:00
https://arxiv.org/abs/2606.04021
https://arxiv.org/pdf/2606.04021v1
2606.04021
null
0
0
false
null
null
0.35
2bbd135e974bdbf6d0306032a4adb89962a70f145e2c380cbb4063d72814d5e0
[ "arxiv", "semantic_scholar" ]
Structure-Guided Adaptive Propagation for Protein-Protein Interaction Site Prediction
Accurate prediction of protein-protein interaction sites (PPIS) is essential for understanding cellular processes, disease mechanisms, and therapeutic target discovery. Graph-based deep learning has advanced PPIS prediction by incorporating residue-level structural context. However, most graph-based models still rely o...
[ "Enqiang Zhu", "Yizi Liu", "Yilong Luo", "Yao Chen", "Yu Zhang", "Baoshan Ma" ]
[ "cs.AI" ]
[ "Computer Science" ]
2026-06-01T00:00:00
https://arxiv.org/abs/2606.01781
https://arxiv.org/pdf/2606.01781v1
2606.01781
null
0
0
false
null
null
0.35
8ca15f915155713f54943353f5b4b9e6af4ceabda10e34de0f67d0ef46d07d85
[ "arxiv", "semantic_scholar" ]
AMix-2: Establishing Protein as a Native Modality in Large Language Models
We present AMix-2, a protein-text foundation model that establishes protein as a native modality in large language models (LLMs), unifying protein understanding and sequence design within a single foundation model. AMix-2 is built upon two key ideas: (1) a unified protein-text formulation that embeds natural language a...
[ "Keyue Qiu", "Yixin Wu", "Lihao Wang", "Yawen Ouyang", "Jixiang Yu", "Zihan Zhou", "Changze Lv", "Dongyu Xue", "Yuxuan Song", "Xinbo Zhang", "Hao Wang", "Jiangtao Feng", "Zhiqiang Gao", "Lijun Wu", "Xiaoqing Zheng", "Ka-Chun Wong", "Lei Bai", "Ya-Qin Zhang", "Wei-Ying Ma", "Dah...
[ "q-bio.BM", "cs.AI" ]
[ "Biology", "Computer Science" ]
2026-05-29T00:00:00
https://arxiv.org/abs/2605.30963
https://arxiv.org/pdf/2605.30963v1
2605.30963
null
0
0
false
null
null
0.35
27ca13b36cf993fbd2645d1eeff7b54b139fc4615dc893021602240f66fde2fd
[ "arxiv", "semantic_scholar" ]
Atom-level Protein Representation Learning Improves Protein Structure Prediction
Recent advances in generative modeling show that pretrained representations can improve generation as conditioning features or alignment targets. Motivated by this, we study protein representations for predicting structures beyond conventional function annotation. We propose TriProRep, a structure-aware pretraining met...
[ "Taewon Kim", "Hyosoon Jang", "Hyunjin Seo", "Seonghwan Seo", "Hyeongwoo Kim", "Wonho Zhung", "Mingyeong Shin", "Wooyoun Kim", "Sungsoo Ahn" ]
[ "q-bio.BM", "cs.AI" ]
[ "Biology", "Computer Science" ]
2026-05-21T00:00:00
https://arxiv.org/abs/2605.22133
https://arxiv.org/pdf/2605.22133v3
2605.22133
null
0
0
false
null
null
0.35
877b175f6bb2cb864fffd0f095bb42ae4943f860f74df5445e19a4bbf23378de
[ "arxiv", "semantic_scholar" ]
Structural Interpretations of Protein Language Model Representations via Differentiable Graph Partitioning
Protein language models such as ESM-2 learn rich residue representations that achieve strong performance on protein function prediction, but their features remain difficult to interpret as structural $\&$ evolutionary signals are encoded in dense latent spaces. We propose a plug-$\&$-play framework that projects ESM-2 ...
[ "Siddhant Dutta", "Edward Tan Beng Wai", "Soumick Sarker", "Pasan Gunawardane", "Jagath C. Rajapakse" ]
[ "cs.LG", "cs.AI", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2026-05-09T00:00:00
https://arxiv.org/abs/2605.10985
https://arxiv.org/pdf/2605.10985v1
2605.10985
null
0
0
false
null
null
0.35
db93d0bc6e7ba59e810d3ca8284e31894b682acdf22b257e42ac0fbdac7dc1e6
[ "arxiv", "semantic_scholar" ]
ProteinJEPA: Latent prediction complements protein language models
Protein language models are trained primarily with masked language modeling (MLM), which predicts amino-acid identities at masked positions. We ask whether latent-space prediction can complement these token-level objectives under matched wall-clock budget. Across pretrained and random-init protein sequence encoders at ...
[ "Dan Ofer", "Dafna Shahaf", "Michal Linial" ]
[ "cs.LG", "cs.AI", "q-bio.BM", "stat.ML" ]
[ "Computer Science", "Biology", "Mathematics" ]
2026-05-08T00:00:00
https://arxiv.org/abs/2605.07554
https://arxiv.org/pdf/2605.07554v1
2605.07554
null
0
0
false
null
null
0.35
0e173453c857154935b528bc7b7cb2eabb08e7d9bcd1e397e97bf180b93df6c4
[ "arxiv", "semantic_scholar" ]
ProtSent: Protein Sentence Transformers
Protein language models (pLMs) produce per-residue representations that capture evolutionary and structural information, yet their mean-pooled sequence embeddings are not explicitly trained to reflect functional, evolutionary or structural similarity between proteins. We present Protein Sentence Transformers (ProtSent)...
[ "Dan Ofer", "Oriel Perets", "Michal Linial", "Nadav Rappoport" ]
[ "cs.LG", "cs.CL" ]
[ "Computer Science" ]
2026-05-07T00:00:00
https://arxiv.org/abs/2605.06830
https://arxiv.org/pdf/2605.06830v1
2605.06830
null
0
0
false
null
null
0.35
a002f1dab6946b4f6d0de16dc2bea7cb2812c9d0637198b47185b56397bfc963
[ "arxiv", "semantic_scholar" ]
Better Protein Function Prediction by Modeling Survivorship Bias
Protein sequence data from nature exhibits survivorship bias: we only observe data from those organisms that survive and reproduce, while non-functional protein mutations are eliminated by natural selection. Thus, predicting whether a protein sequence is functional often requires learning from positive examples alone. ...
[ "Zhongmou Chao", "Poompol Buathong", "Ekaterina Selivanovitch", "Susan Daniel", "Peter I. Frazier" ]
[ "cs.LG", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2026-05-07T00:00:00
https://arxiv.org/abs/2605.06879
https://arxiv.org/pdf/2605.06879v1
2605.06879
null
0
0
false
null
null
0.35
0160c746d795fb93edde86692344de66f756e9585e28f87f19d3c574e4c56d48
[ "arxiv", "semantic_scholar" ]
Targeted Linguistic Analysis of Sign Language Models with Minimal Translation Pairs
Models of sign language have historically lagged behind those for spoken language (text and speech). Recent work has greatly improved their performance on tasks like sign language translation and isolated sign recognition. However, it remains unclear to what extent existing models capture various linguistic phenomena o...
[ "Serpil KarabΓΌklΓΌ", "Kanishka Misra", "Shester Gueuwou", "Diane Brentari", "Greg Shakhnarovich", "Karen Livescu" ]
[ "cs.CL" ]
[ "Computer Science" ]
2026-04-29T00:00:00
https://arxiv.org/abs/2604.27232
https://arxiv.org/pdf/2604.27232v2
2604.27232
10.48550/arXiv.2604.27232
0
0
false
null
arXiv.org
0.55
7b983dc87dcd7c6de4d0a1e0eaa81de2c6bbc08aecaf31285565e7426bb841a8
[ "arxiv", "semantic_scholar" ]
TriFit: Trimodal Fusion with Protein Dynamics for Mutation Fitness Prediction
Predicting the functional impact of single amino acid substitutions (SAVs) is central to understanding genetic disease and engineering therapeutic proteins. While protein language models and structure-based methods have achieved strong performance on this task, they systematically neglect protein dynamics; residue flex...
[ "Seungik Cho" ]
[ "cs.LG", "q-bio.BM", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2026-04-13T00:00:00
https://arxiv.org/abs/2604.12026
https://arxiv.org/pdf/2604.12026v1
2604.12026
10.48550/arXiv.2604.12026
0
0
false
null
arXiv.org
0.542
f6ef3dbd4c2d0ecc1c194c9780bc2c4a5c1737fcc4f9ca45959a2d45664202c8
[ "arxiv", "semantic_scholar" ]
Rethinking Token Prediction: Tree-Structured Diffusion Language Model
Discrete diffusion language models have emerged as a competitive alternative to auto-regressive language models, but training them efficiently under limited parameter and memory budgets remains challenging. Modern architectures are predominantly based on a full-vocabulary token prediction layer, which accounts for a su...
[ "Zihao Wu", "Haoming Yang", "Juncheng Dong", "Vahid Tarokh" ]
[ "cs.CL", "cs.LG" ]
[ "Computer Science" ]
2026-04-04T00:00:00
https://arxiv.org/abs/2604.03537
https://arxiv.org/pdf/2604.03537v1
2604.03537
10.48550/arXiv.2604.03537
0
0
false
null
arXiv.org
0.5317
5cd5b775f73bda757c9e0ee7d672d210d6921b01a58fc4bd66b545c57fabd49d
[ "arxiv", "semantic_scholar" ]
Sampling at intermediate temperatures is optimal for training large language models in protein structure prediction
We investigate the parameter space of transformer models trained on protein sequence data using a statistical mechanics framework, sampling the loss landscape at varying temperatures by Langevin dynamics to characterize the low-loss manifold and understand the mechanisms underlying the superior performance of transform...
[ "L. Ghiringhelli", "A. Zambon", "G. Tiana" ]
[ "cond-mat.dis-nn", "cs.LG", "q-bio.BM" ]
[ "Computer Science", "Physics", "Biology" ]
2026-03-31T00:00:00
https://arxiv.org/abs/2603.29529
https://arxiv.org/pdf/2603.29529v1
2603.29529
10.48550/arXiv.2603.29529
0
0
false
null
arXiv.org
0.5271
5a7bfbdbb17debee63d7dc76a7d9cd3d77aa9dc92a88a2dd96ce4a58b472aa10
[ "arxiv", "semantic_scholar" ]
Merge and Conquer: Instructing Multilingual Models by Adding Target Language Weights
Large Language Models (LLMs) remain heavily centered on English, with limited performance in low-resource languages. Existing adaptation approaches, such as continual pre-training, demand significant computational resources. In the case of instructed models, high-quality instruction data is also required, both of which...
[ "Eneko Valero", "Maria Ribalta i Albado", "Oscar Sainz", "Naiara Perez", "German Rigau" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2026-03-30T00:00:00
https://arxiv.org/abs/2603.28263
https://arxiv.org/pdf/2603.28263v1
2603.28263
10.48550/arXiv.2603.28263
0
0
false
null
arXiv.org
0.5259
9847154ed392bb82e7bc3ce3b3a65071cf778f1242631fc4cef375fc4dae1124
[ "arxiv", "semantic_scholar" ]
Introducing MELI: the Mandarin-English Language Interview Corpus
We introduce the Mandarin-English Language Interview (MELI) Corpus, an open-source resource of 29.8 hours of speech from 51 Mandarin-English bilingual speakers. MELI combines matched sessions in Mandarin and English with two speaking styles: read sentences and spontaneous interviews about language varieties, standardne...
[ "Suyuan Liu", "Molly Babel" ]
[ "cs.CL" ]
[ "Computer Science" ]
2026-03-27T00:00:00
https://arxiv.org/abs/2603.27043
https://arxiv.org/pdf/2603.27043v2
2603.27043
10.63317/3umiyc4sxwhk
0
0
true
null
arXiv.org
0.8075
1a8e942c570ec1a135a7c5d4dc93befb71353719b61f0b94db814cd5c9d2833d
[ "arxiv", "semantic_scholar" ]
Central Dogma Transformer III: Interpretable AI Across DNA, RNA, and Protein
Biological AI models increasingly predict complex cellular responses, yet their learned representations remain disconnected from the molecular processes they aim to capture. We present CDT-III, which extends mechanism-oriented AI across the full central dogma: DNA, RNA, and protein. Its two-stage Virtual Cell Embedder ...
[ "Nobuyuki Ota" ]
[ "cs.LG", "q-bio.GN" ]
[ "Computer Science", "Biology" ]
2026-03-24T00:00:00
https://arxiv.org/abs/2603.23361
https://arxiv.org/pdf/2603.23361v2
2603.23361
10.48550/arXiv.2603.23361
0
0
false
null
arXiv.org
0.5191
74b4d0a833d0a0d211a85ff9a40d6f83f116c8f371a835e80fef0e0af83894b0
[ "arxiv", "semantic_scholar" ]
Task-Specific Efficiency Analysis: When Small Language Models Outperform Large Language Models
Large Language Models achieve remarkable performance but incur substantial computational costs unsuitable for resource-constrained deployments. This paper presents the first comprehensive task-specific efficiency analysis comparing 16 language models across five diverse NLP tasks. We introduce the Performance-Efficienc...
[ "Jinghan Cao", "Yu Ma", "Xinjin Li", "Qingyang Ren", "Xiangyun Chen" ]
[ "cs.CL", "cs.LG" ]
[ "Computer Science" ]
2026-03-22T00:00:00
https://arxiv.org/abs/2603.21389
https://arxiv.org/pdf/2603.21389v1
2603.21389
10.14428/esann/2026.es2026-274
9
1
false
null
The European Symposium on Artificial Neural Networks
0.5168
ca82ff6b387612787890f2f522dc113d867a0ef39f15c8b538fcc7d49f7fa677
[ "arxiv", "semantic_scholar" ]
Cross-Granularity Representations for Biological Sequences: Insights from ESM and BiGCARP
Recent advances in general-purpose foundation models have stimulated the development of large biological sequence models. While natural language shows symbolic granularity (characters, words, sentences), biological sequences exhibit hierarchical granularity whose levels (nucleotides, amino acids, protein domains, genes...
[ "Hanlin Xiao", "Rainer Breitling", "Eriko Takano", "Mauricio A. Álvarez" ]
[ "cs.LG" ]
[ "Computer Science" ]
2026-03-21T00:00:00
https://arxiv.org/abs/2603.20825
https://arxiv.org/pdf/2603.20825v1
2603.20825
10.1109/BIBM66473.2025.11356265
0
0
false
null
IEEE International Conference on Bioinformatics and Biomedicine
0.5156
f62f079d344668a8da9e108e465f468bc97ae2dfc32bc99307cd0a72e3d24188
[ "arxiv", "semantic_scholar" ]
From Snapshots to Symphonies: The Evolution of Protein Prediction from Static Structures to Generative Dynamics and Multimodal Interactions
The protein folding problem has been fundamentally transformed by artificial intelligence, evolving from static structure prediction toward the modeling of dynamic conformational ensembles and complex biomolecular interactions. This review systematically examines the paradigm shift in AI driven protein science across f...
[ "Jingzhi Chen", "Lijian Xu" ]
[ "cs.CV" ]
[ "Computer Science" ]
2026-03-19T00:00:00
https://arxiv.org/abs/2603.18505
https://arxiv.org/pdf/2603.18505v1
2603.18505
10.48550/arXiv.2603.18505
1
0
false
null
arXiv.org
0.5133
8b422bdf48b01054475ad524262a98b442d93a3196c1372bab5ed383b7c27c79
[ "arxiv", "semantic_scholar" ]
Integrative modelling of protein-glycan interactions with HADDOCK3
Glycans are structurally diverse and flexible biomolecules that play key roles in many biological processes. Their conformational variability makes the modeling of their interactions with proteins particularly challenging. This chapter presents a step-by-step protocol for modeling protein-glycan interactions using HADD...
[ "Victor Reys", "Marco Giulini", "Alexandre M. J. J. Bonvin" ]
[ "q-bio.BM" ]
[ "Biology" ]
2026-03-18T00:00:00
https://arxiv.org/abs/2603.17251
https://arxiv.org/pdf/2603.17251v1
2603.17251
null
0
0
false
null
null
0.3259
5c142e2cc97364a477a5751796bb3145d048a3a33452ce2c4487484b411bf719
[ "arxiv", "semantic_scholar" ]
Robust Language Identification for Romansh Varieties
The Romansh language has several regional varieties, called idioms, which sometimes have limited mutual intelligibility. Despite this linguistic diversity, there has been a lack of documented efforts to build a language identification (LID) system that can distinguish between these idioms. Since Romansh LID should also...
[ "Charlotte Model", "Sina Ahmadi", "Jannis Vamvas" ]
[ "cs.CL" ]
[ "Computer Science" ]
2026-03-16T00:00:00
https://arxiv.org/abs/2603.15969
https://arxiv.org/pdf/2603.15969v2
2603.15969
10.48550/arXiv.2603.15969
1
0
false
null
arXiv.org
0.5099
546c6c9d10d36a66d8559116e5310a5fac6b86ec200f9c2eeb9fc5a55770ee28
[ "arxiv", "semantic_scholar" ]
Reverse Distillation: Consistently Scaling Protein Language Model Representations
Unlike the predictable scaling laws in natural language processing and computer vision, protein language models (PLMs) scale poorly: for many tasks, models within the same family plateau or even decrease in performance, with mid-sized models often outperforming the largest in the family. We introduce Reverse Distillati...
[ "Darius Catrina", "Christian Bepler", "Samuel Sledzieski", "Rohit Singh" ]
[ "cs.LG", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2026-03-08T00:00:00
https://arxiv.org/abs/2603.07710
https://arxiv.org/pdf/2603.07710v1
2603.07710
10.48550/arXiv.2603.07710
1
0
true
https://github.com/rohitsinghlab/plm_reverse_distillation
arXiv.org
0.7739
354177cd48b5857eb8de69946e5d2468cdcc5165bb0f02b26bc6e2c5313fd3ae
[ "arxiv", "semantic_scholar" ]
Inference-Time Toxicity Mitigation in Protein Language Models
Protein language models (PLMs) are becoming practical tools for de novo protein design, yet their dual-use potential raises safety concerns. We show that domain adaptation to specific taxonomic groups can elicit toxic protein generation, even when toxicity is not the training objective. To address this, we adapt Logit ...
[ "Manuel FernΓ‘ndez Burda", "Santiago Aranguri", "IvΓ‘n Arcuschin Moreno", "Enzo Ferrante" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2026-03-04T00:00:00
https://arxiv.org/abs/2603.04045
https://arxiv.org/pdf/2603.04045v1
2603.04045
10.48550/arXiv.2603.04045
0
0
false
null
arXiv.org
0.4961
7d765f6bd5fc5ccd6161eea473c9184004ad2e915edd17dadba0cc3210530035
[ "arxiv", "semantic_scholar" ]
Building a Strong Instruction Language Model for a Less-Resourced Language
Large language models (LLMs) have become an essential tool for natural language processing and artificial intelligence in general. Current open-source models are primarily trained on English texts, resulting in poorer performance on less-resourced languages and cultures. We present a set of methodological approaches ne...
[ "Domen Vreő", "Tjaőa Arčon", "Timotej Petrič", "Dario Vajda", "Marko Robnik-Šikonja", "Iztok Lebar Bajec" ]
[ "cs.CL", "cs.LG" ]
[ "Computer Science" ]
2026-03-02T00:00:00
https://arxiv.org/abs/2603.01691
https://arxiv.org/pdf/2603.01691v1
2603.01691
10.48550/arXiv.2603.01691
1
0
true
null
arXiv.org
0.7632
fa76891b27c573bb84ee4a7a5f133548d5e487aab28969c9776638fd8e2a5e01
[ "arxiv", "semantic_scholar" ]
CoPeP: Benchmarking Continual Pretraining for Protein Language Models
Protein language models (pLMs) have recently gained significant attention for their ability to uncover relationships between sequence, structure, and function from evolutionary statistics, thereby accelerating therapeutic drug discovery. These models learn from large protein databases that are continuously updated by t...
[ "Darshan Patil", "Pranshu Malviya", "Mathieu Reymond", "Quentin Fournier", "Sarath Chandar" ]
[ "cs.LG" ]
[ "Computer Science" ]
2026-02-27T00:00:00
https://arxiv.org/abs/2603.00253
https://arxiv.org/pdf/2603.00253v2
2603.00253
10.48550/arXiv.2603.00253
0
0
false
null
arXiv.org
0.4904
cd1ae30c83a185e14356aaf886458a66daa9f1d6c5c56030eb41238790c1e750
[ "arxiv", "semantic_scholar" ]
Protein Language Models Diverge from Natural Language: Comparative Analysis and Improved Inference
Modern Protein Language Models (PLMs) apply transformer-based model architectures from natural language processing to biological sequences, predicting a variety of protein functions and properties. However, protein language has key differences from natural language, such as a rich functional space despite a vocabulary ...
[ "Anna Hart", "Chi Han", "Jeonghwan Kim", "Huimin Zhao", "Heng Ji" ]
[ "cs.LG", "cs.AI", "cs.CL", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2026-02-24T00:00:00
https://arxiv.org/abs/2602.20449
https://arxiv.org/pdf/2602.20449v1
2602.20449
10.48550/arXiv.2602.20449
0
0
false
null
arXiv.org
0.487
fce9ef0f1765578e157b0d25acca84cc9ee92bd3dce842954e8a8c18b188401c
[ "arxiv", "semantic_scholar" ]
BeamVLM for Low-altitude Economy: Generative Beam Prediction via Vision-language Models
For low-altitude economy (LAE), fast and accurate beam prediction between high-mobility unmanned aerial vehicles (UAVs) and ground base stations is of paramount importance, which ensures seamless coverage and reliable communications. However, existing deep learning-based beam prediction methods lack high-level semantic...
[ "Chenran Kou", "Changsheng You", "Mingjiang Wu", "Dingzhu Wen", "Zezhong Zhang", "Chengwen Xing" ]
[ "cs.NI", "cs.IT" ]
[ "Computer Science", "Mathematics" ]
2026-02-23T00:00:00
https://arxiv.org/abs/2602.19929
https://arxiv.org/pdf/2602.19929v1
2602.19929
10.48550/arXiv.2602.19929
1
0
false
null
arXiv.org
0.4858
39dcd2d9ac944e68a62b34cb8a42d6e302188d247e477387a052da3067cc84c8
[ "arxiv", "semantic_scholar" ]
STProtein: predicting spatial protein expression from multi-omics data
The integration of spatial multi-omics data from single tissues is crucial for advancing biological research. However, a significant data imbalance impedes progress: while spatial transcriptomics data is relatively abundant, spatial proteomics data remains scarce due to technical limitations and high costs. To overcome...
[ "Zhaorui Jiang", "Yingfang Yuan", "Lei Hu", "Wei Pang" ]
[ "cs.AI" ]
[ "Computer Science" ]
2026-02-05T00:00:00
https://arxiv.org/abs/2602.05811
https://arxiv.org/pdf/2602.05811v1
2602.05811
10.48550/arXiv.2602.05811
0
0
true
https://github.com/zhaorui-bi/STProtein
arXiv.org
0.719
25dc729932d8178547f234c0a1b91071752207d8855a087cef99fcfa5a038908
[ "arxiv", "semantic_scholar" ]
Controlling Repetition in Protein Language Models
Protein language models (PLMs) have enabled advances in structure prediction and de novo protein design, yet they frequently collapse into pathological repetition during generation. Unlike in text, where repetition merely reduces readability, in proteins it undermines structural confidence and functional viability. To ...
[ "Jiahao Zhang", "Zeqing Zhang", "Di Wang", "Lijie Hu" ]
[ "q-bio.BM", "cs.AI" ]
[ "Biology", "Computer Science" ]
2026-01-31T00:00:00
https://arxiv.org/abs/2602.00782
https://arxiv.org/pdf/2602.00782v1
2602.00782
10.48550/arXiv.2602.00782
3
0
false
null
arXiv.org
0.4595
3b1e983c10ad679f44efe516c25757ed09fc760ae26e3899d43f8d0b605a9300
[ "arxiv", "semantic_scholar" ]
CalPro: Prior-Aware Evidential--Conformal Prediction with Structure-Aware Guarantees for Protein Structures
Deep protein structure predictors such as AlphaFold provide confidence estimates (e.g., pLDDT) that are often miscalibrated and degrade under distribution shifts across experimental modalities, temporal changes, and intrinsically disordered regions. We introduce CalPro, a prior-aware evidential-conformal framework for ...
[ "Ibne Farabi Shihab", "Sanjeda Akter", "Anuj Sharma" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2026-01-12T00:00:00
https://arxiv.org/abs/2601.07201
https://arxiv.org/pdf/2601.07201v1
2601.07201
10.48550/arXiv.2601.07201
0
0
false
null
arXiv.org
0.4377
8c06ab9f0ef554e926895b82f6f23c06c9ccf8d15125591eaf5ba6433931edba
[ "arxiv", "semantic_scholar" ]
Knowledge Distillation of a Protein Language Model Yields a Foundational Implicit Solvent Model
Implicit solvent models (ISMs) promise to deliver the accuracy of explicit solvent simulations at a fraction of the computational cost. However, despite decades of development, their accuracy has remained insufficient for many critical applications, particularly for simulating protein folding and the behavior of intrin...
[ "Justin Airas", "Bin Zhang" ]
[ "physics.bio-ph", "physics.chem-ph", "physics.comp-ph" ]
[ "Physics", "Medicine" ]
2026-01-08T00:00:00
https://arxiv.org/abs/2601.05388
https://arxiv.org/pdf/2601.05388v2
2601.05388
null
3
0
false
null
arXiv.org
0.4331
8108741252aedfc85cdc48b2017260c56b8adc01e8f4b65009708ca6b1b25d1d
[ "arxiv", "semantic_scholar" ]
Quantum Simulation of Protein Fragment Electronic Structure Using Moment-based Adaptive Variational Quantum Algorithms
Background: Understanding electronic interactions in protein active sites is fundamental to drug discovery and enzyme engineering, but remains computationally challenging due to exponential scaling of quantum mechanical calculations. Results: We present a quantum-classical hybrid framework for simulating protein fragme...
[ "Biraja Ghoshal" ]
[ "q-bio.QM", "cs.ET" ]
[ "Biology", "Computer Science" ]
2026-01-02T00:00:00
https://arxiv.org/abs/2601.00656
https://arxiv.org/pdf/2601.00656v1
2601.00656
10.48550/arXiv.2601.00656
0
0
false
null
arXiv.org
0.4263
3a3f618d9a2d8c4f089f480f98da544cf9129429dee02de1958c9b28294e2f01
[ "arxiv", "semantic_scholar" ]
Physio-DPO: Aligning Large Language Models with the Protein Energy Landscape to Eliminate Structural Hallucinations
Large Protein Language Models have shown strong potential for generative protein design, yet they frequently produce structural hallucinations, generating sequences with high linguistic likelihood that fold into thermodynamically unstable conformations. Existing alignment approaches such as Direct Preference Optimizati...
[ "QiWei Meng" ]
[ "cs.CL", "cs.CE", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2026-01-02T00:00:00
https://arxiv.org/abs/2601.00647
https://arxiv.org/pdf/2601.00647v1
2601.00647
10.48550/arXiv.2601.00647
1
0
false
null
arXiv.org
0.4263
ef39d241eab949d3efe800528741c9edc69bf639b9982c7d2bc4f769fdcf64a3
[ "arxiv", "semantic_scholar" ]
HD-Prot: A Protein Language Model for Joint Sequence-Structure Modeling with Continuous Structure Tokens
Proteins inherently possess a consistent sequence-structure duality. The abundance of protein sequence data, which can be readily represented as discrete tokens, has driven fruitful developments in protein language models (pLMs). A key remaining challenge, however, is how to effectively integrate continuous structural ...
[ "Yi Zhou", "Haohao Qu", "Yunqing Liu", "Shanru Lin", "Le Song", "Wenqi Fan" ]
[ "cs.CE", "cs.AI" ]
[ "Computer Science" ]
2025-12-17T00:00:00
https://arxiv.org/abs/2512.15133
https://arxiv.org/pdf/2512.15133v3
2512.15133
10.48550/arXiv.2512.15133
4
0
false
null
arXiv.org
0.4079
8a43a9c0833ff2879a90ef7a720ceb443aba6543f1531486d21d70e48f00eff3
[ "arxiv", "semantic_scholar" ]
Large language models have learned to use language
Acknowledging that large language models have learned to use language can open doors to breakthrough language science. Achieving these breakthroughs may require abandoning some long-held ideas about how language knowledge is evaluated and reckoning with the difficult fact that we have entered a post-Turing test era.
[ "Gary Lupyan" ]
[ "cs.CL" ]
[ "Computer Science" ]
2025-12-13T00:00:00
https://arxiv.org/abs/2512.12447
https://arxiv.org/pdf/2512.12447v1
2512.12447
10.48550/arXiv.2512.12447
0
0
false
null
arXiv.org
0.4033
3274b8e6361e5f626a23dcdf3d21269828073d7b99bef850e3fd10e198486cf9
[ "arxiv", "semantic_scholar" ]
Self Distillation Fine-Tuning of Protein Language Models Improves Versatility in Protein Design
Supervised fine-tuning (SFT) is a standard approach for adapting large language models to specialized domains, yet its application to protein sequence modeling and protein language models (PLMs) remains ad hoc. This is in part because high-quality annotated data are far more difficult to obtain for proteins than for na...
[ "Amin Tavakoli", "Raswanth Murugan", "Ozan Gokdemir", "Arvind Ramanathan", "Frances Arnold", "Anima Anandkumar" ]
[ "cs.LG", "cs.CE" ]
[ "Computer Science" ]
2025-12-10T00:00:00
https://arxiv.org/abs/2512.09329
https://arxiv.org/pdf/2512.09329v1
2512.09329
10.48550/arXiv.2512.09329
0
0
false
null
arXiv.org
0.3999
84809160d7b398c91a840edeca946d2c754922ae674dc128c66faaf21cbac684
[ "arxiv", "semantic_scholar" ]
Soft Inductive Bias Approach via Explicit Reasoning Perspectives in Inappropriate Utterance Detection Using Large Language Models
Recent incidents in certain online games and communities, where anonymity is guaranteed, show that unchecked inappropriate remarks frequently escalate into verbal abuse and even criminal behavior, raising significant social concerns. Consequently, there is a growing need for research on techniques that can detect inapp...
[ "Ju-Young Kim", "Ji-Hong Park", "Se-Yeon Lee", "Sujin Park", "Gun-Woo Kim" ]
[ "cs.CL" ]
[ "Computer Science" ]
2025-12-09T00:00:00
https://arxiv.org/abs/2512.08480
https://arxiv.org/pdf/2512.08480v1
2512.08480
10.48550/arXiv.2512.08480
0
0
false
null
arXiv.org
0.3987
9ba643e751032fea310460ad18dd169975fd9a5b6f0e49b49795abedebb99662
[ "arxiv", "semantic_scholar" ]
Protein Secondary Structure Prediction Using Transformers
Predicting protein secondary structures such as alpha helices, beta sheets, and coils from amino acid sequences is essential for understanding protein function. This work presents a transformer-based model that applies attention mechanisms to protein sequence data to predict structural motifs. A sliding-window data aug...
[ "Manzi Kevin Maxime" ]
[ "cs.AI" ]
[ "Computer Science" ]
2025-12-09T00:00:00
https://arxiv.org/abs/2512.08613
https://arxiv.org/pdf/2512.08613v1
2512.08613
10.48550/arXiv.2512.08613
0
0
false
null
arXiv.org
0.3987
99d189816a72fcfcddc3b3cdacae324df68e34ffef6119675ee59b392a606c82
[ "arxiv", "semantic_scholar" ]
Classifying German Language Proficiency Levels Using Large Language Models
Assessing language proficiency is essential for education, as it enables instruction tailored to learners needs. This paper investigates the use of Large Language Models (LLMs) for automatically classifying German texts according to the Common European Framework of Reference for Languages (CEFR) into different proficie...
[ "Elias-Leander Ahlers", "Witold Brunsmann", "Malte Schilling" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2025-12-06T00:00:00
https://arxiv.org/abs/2512.06483
https://arxiv.org/pdf/2512.06483v1
2512.06483
10.1109/FLLM67465.2025.11390912
1
1
false
null
null
0.2516
edde90edeaeb66075f25b08e388d7a8200913a436424fafe35130994ca6732d5
[ "arxiv", "semantic_scholar" ]
Small Language Models Reshape Higher Education: Courses, Textbooks, and Teaching
While large language models (LLMs) have introduced novel paradigms in science and education, their adoption in higher education is constrained by inherent limitations. These include a tendency to produce inaccuracies and high computational requirements, which compromise the strict demands for accurate and reliable know...
[ "Jian Zhang", "Jia Shao" ]
[ "physics.ed-ph", "cs.CL" ]
[ "Physics", "Computer Science" ]
2025-12-02T00:00:00
https://arxiv.org/abs/2512.06001
https://arxiv.org/pdf/2512.06001v1
2512.06001
10.48550/arXiv.2512.06001
0
0
false
null
arXiv.org
0.3907
a0d097ff2267023d9e4988fc24ed75aa95ef7a815bdd28db41101eee7a0dfc6f
[ "arxiv", "semantic_scholar" ]
Layer Probing Improves Kinase Functional Prediction with Protein Language Models
Protein language models (PLMs) have transformed sequence-based protein analysis, yet most applications rely only on final-layer embeddings, which may overlook biologically meaningful information encoded in earlier layers. We systematically evaluate all 33 layers of ESM-2 for kinase functional prediction using both unsu...
[ "Ajit Kumar", "IndraPrakash Jha" ]
[ "q-bio.QM", "cs.AI", "cs.LG" ]
[ "Computer Science", "Biology" ]
2025-11-29T00:00:00
https://arxiv.org/abs/2512.00376
https://arxiv.org/pdf/2512.00376v1
2512.00376
10.48550/arXiv.2512.00376
1
0
false
null
arXiv.org
0.3873
a99edac5fb61c22f532891c8c445ed6b3de89af4abe31d2f6d1e5946f58699c1
[ "arxiv", "semantic_scholar" ]
Language-conditioned world model improves policy generalization by reading environmental descriptions
To interact effectively with humans in the real world, it is important for agents to understand language that describes the dynamics of the environment--that is, how the environment behaves--rather than just task instructions specifying "what to do". Understanding this dynamics-descriptive language is important for hum...
[ "Anh Nguyen", "Stefan Lee" ]
[ "cs.CL", "cs.LG" ]
[ "Computer Science" ]
2025-11-28T00:00:00
https://arxiv.org/abs/2511.22904
https://arxiv.org/pdf/2511.22904v1
2511.22904
10.48550/arXiv.2511.22904
0
0
false
null
arXiv.org
0.3861
1d2eefd3f45c2512327996cda188ad850678166a12210efbdc9fa5ea932f8663
[ "arxiv", "semantic_scholar" ]
Swarms of Large Language Model Agents for Protein Sequence Design with Experimental Validation
Designing proteins de novo with tailored structural, physicochemical, and functional properties remains a grand challenge in biotechnology, medicine, and materials science, due to the vastness of sequence space and the complex coupling between sequence, structure, and function. Current state-of-the-art generative metho...
[ "Fiona Y. Wang", "Di Sheng Lee", "David L. Kaplan", "Markus J. Buehler" ]
[ "cs.AI", "cond-mat.mes-hall", "cond-mat.soft", "cs.CL", "cs.LG" ]
[ "Computer Science", "Physics" ]
2025-11-27T00:00:00
https://arxiv.org/abs/2511.22311
https://arxiv.org/pdf/2511.22311v1
2511.22311
10.48550/arXiv.2511.22311
4
0
false
null
arXiv.org
0.385
8a89f3b0e767124b3ecac378cd663d2380ea5d550ae836716db1baf52997f70a
[ "arxiv", "semantic_scholar" ]
DeepPNI: Language- and graph-based model for mutation-driven protein-nucleic acid energetics
The interaction between proteins and nucleic acids is crucial for processes that sustain cellular function, including DNA maintenance and the regulation of gene expression and translation. Amino acid mutations in protein-nucleic acid complexes often lead to vital diseases. Experimental techniques have their own specifi...
[ "Somnath Mondal", "Tinkal Mondal", "Soumajit Pramanik", "Rukmankesh Mehra" ]
[ "q-bio.BM", "cs.AI" ]
[ "Biology", "Computer Science" ]
2025-11-27T00:00:00
https://arxiv.org/abs/2511.22239
https://arxiv.org/pdf/2511.22239v1
2511.22239
10.48550/arXiv.2511.22239
0
0
false
null
arXiv.org
0.385
b5353a619eaea8460535a73e12d9d3852e5dd4eb66907753d18382b152f074cc
[ "arxiv", "semantic_scholar" ]
Protein Secondary Structure Prediction Using 3D Graphs and Relation-Aware Message Passing Transformers
In this study, we tackle the challenging task of predicting secondary structures from protein primary sequences, a pivotal initial stride towards predicting tertiary structures, while yielding crucial insights into protein activity, relationships, and functions. Existing methods often utilize extensive sets of unlabele...
[ "Disha Varshney", "Samarth Garg", "Sarthak Tyagi", "Deeksha Varshney", "Nayan Deep", "Asif Ekbal" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2025-11-17T00:00:00
https://arxiv.org/abs/2511.13685
https://arxiv.org/pdf/2511.13685v1
2511.13685
10.48550/arXiv.2511.13685
0
0
false
null
arXiv.org
0.3735
859d10bcf2c0d311d4ca6c85f4ab9d3caf30455d644e046df07579d451de2c74
[ "arxiv", "semantic_scholar" ]
Studies with impossible languages falsify LMs as models of human language
According to Futrell and Mahowald [arXiv:2501.17047], both infants and language models (LMs) find attested languages easier to learn than impossible languages that have unnatural structures. We review the literature and show that LMs often learn attested and many impossible languages equally well. Difficult to learn im...
[ "Jeffrey S. Bowers", "Jeff Mitchell" ]
[ "cs.CL" ]
[ "Computer Science" ]
2025-11-14T00:00:00
https://arxiv.org/abs/2511.11389
https://arxiv.org/pdf/2511.11389v1
2511.11389
10.48550/arXiv.2511.11389
1
0
false
null
arXiv.org
0.3701
f90693cfcb34bb06f6da918410e6071af0a85d07f8c013ffed0acd13a591e1dc
[ "arxiv", "semantic_scholar" ]
Boosting In-Silicon Directed Evolution with Fine-Tuned Protein Language Model and Tree Search
Protein evolution through amino acid mutations is a cornerstone of life sciences. Recent advances in protein language models have shown rich evolutionary patterns, offering unprecedented potential for in-silicon directed evolution. However, existing directed evolution methods largely rely on heuristic evolution strateg...
[ "Yaodong Yang", "Yang Wang", "Jinpeng Li", "Pei Guo", "Da Han", "Guangyong Chen", "Pheng-Ann Heng" ]
[ "cs.AI", "cs.CE" ]
[ "Computer Science" ]
2025-11-13T00:00:00
https://arxiv.org/abs/2511.09900
https://arxiv.org/pdf/2511.09900v4
2511.09900
10.48550/arXiv.2511.09900
0
0
false
null
arXiv.org
0.369
db887845bcd21311022f915d4f4cb72543394233d12ba77db512a8983536728d
[ "arxiv", "semantic_scholar" ]
From Static Structures to Ensembles: Studying and Harnessing Protein Structure Tokenization
Protein structure tokenization converts 3D structures into discrete or vectorized representations, enabling the integration of structural and sequence data. Despite many recent works on structure tokenization, the properties of the underlying discrete representations are not well understood. In this work, we first demo...
[ "Zijing Liu", "Bin Feng", "He Cao", "Yu Li" ]
[ "cs.LG" ]
[ "Computer Science" ]
2025-11-13T00:00:00
https://arxiv.org/abs/2511.10056
https://arxiv.org/pdf/2511.10056v1
2511.10056
10.48550/arXiv.2511.10056
1
0
true
https://github.com/IDEA-XL/TokenMD
arXiv.org
0.5702
fb4597c9e9b5aabf4aadfd5fe87bb078c02f418eb222ac34b819275b6da1526e
[ "arxiv", "semantic_scholar" ]
Joint Design of Protein Surface and Structure Using a Diffusion Bridge Model
Protein-protein interactions (PPIs) are governed by surface complementarity and hydrophobic interactions at protein interfaces. However, designing diverse and physically realistic protein structure and surfaces that precisely complement target receptors remains a significant challenge in computational protein design. I...
[ "Guanlue Li", "Xufeng Zhao", "Fang Wu", "SΓΆren Laue" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2025-11-08T00:00:00
https://arxiv.org/abs/2511.16675
https://arxiv.org/pdf/2511.16675v1
2511.16675
10.48550/arXiv.2511.16675
0
0
false
null
arXiv.org
0.3632
3ae6593ec242f09e125cff955f93079e9f444726bd1bbd13887809491bd31d73
[ "arxiv", "semantic_scholar" ]
Quantifying the Role of OpenFold Components in Protein Structure Prediction
Models such as AlphaFold2 and OpenFold have transformed protein structure prediction, yet their inner workings remain poorly understood. We present a methodology to systematically evaluate the contribution of individual OpenFold components to structure prediction accuracy. We identify several components that are critic...
[ "Tyler L. Hayes", "Giri P. Krishnan" ]
[ "q-bio.BM", "cs.AI" ]
[ "Biology", "Computer Science" ]
2025-11-06T00:00:00
https://arxiv.org/abs/2511.14781
https://arxiv.org/pdf/2511.14781v1
2511.14781
10.48550/arXiv.2511.14781
1
0
false
null
arXiv.org
0.3609
196d7f0b69a25eb0d0446bc422d71c79a3a9a9a39a01cb2c7361217e9b974e66
[ "arxiv", "semantic_scholar" ]
GeoPep: A geometry-aware masked language model for protein-peptide binding site prediction
Multimodal approaches that integrate protein structure and sequence have achieved remarkable success in protein-protein interface prediction. However, extending these methods to protein-peptide interactions remains challenging due to the inherent conformational flexibility of peptides and the limited availability of st...
[ "Dian Chen", "Yunkai Chen", "Tong Lin", "Sijie Chen", "Xiaolin Cheng" ]
[ "eess.SP", "cs.LG" ]
[ "Computer Science", "Engineering" ]
2025-10-30T00:00:00
https://arxiv.org/abs/2510.27040
https://arxiv.org/pdf/2510.27040v1
2510.27040
10.48550/arXiv.2510.27040
1
0
false
null
arXiv.org
0.3529
4f5c67c8776219add5efccfd1dd935c1f2d5cc687012b88b01ecadc3093d86be
[ "arxiv", "semantic_scholar" ]
Precision Design of Cyclic Peptides using AlphaFold
This independent research investigates methods to improve the precision of cyclic peptide generation targeting the HIV gp120 trimer using AlphaFold. The study explores proximity-based hotspot mapping at the CD4 binding site, centroid distance penalization, generative loss tuning, and custom loss function development. T...
[ "Cheuk Sau Au" ]
[ "q-bio.BM" ]
[ "Biology" ]
2025-10-15T00:00:00
https://arxiv.org/abs/2510.13127
https://arxiv.org/pdf/2510.13127v1
2510.13127
null
0
0
false
null
null
0.2136
9f4b6fd0003622d2b0f41321ed3835c8a74e1588375112fe263338aa82471af1
[ "arxiv", "semantic_scholar" ]
Protein as a Second Language for LLMs
Deciphering the function of unseen protein sequences is a fundamental challenge with broad scientific impact, yet most existing methods depend on task-specific adapters or large-scale supervised fine-tuning. We introduce the "Protein-as-Second-Language" framework, which reformulates amino-acid sequences as sentences in...
[ "Xinhui Chen", "Zuchao Li", "Mengqi Gao", "Yufeng Zhang", "Chak Tou Leong", "Haoyang Li", "Jiaqi Chen" ]
[ "cs.LG", "cs.AI", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2025-10-13T00:00:00
https://arxiv.org/abs/2510.11188
https://arxiv.org/pdf/2510.11188v1
2510.11188
10.48550/arXiv.2510.11188
0
0
true
null
arXiv.org
0.5153
cfaabc6209ae2cfb268efc15bbadb592d452e9c2e47c2e08bf452883fabc0bac
[ "arxiv", "semantic_scholar" ]
A Hybrid Quantum-AI Framework for Protein Structure Prediction on NISQ Devices
Variational quantum algorithms provide a direct, physics-based approach to protein structure prediction, but their accuracy is limited by the coarse resolution of the energy landscapes generated on current noisy devices. We propose a hybrid framework that combines quantum computation with deep learning, formulating str...
[ "Yuqi Zhang", "Yuxin Yang", "Feixiong Chen", "Cheng-Chang Lu", "Nima Saeidi", "Samuel L. Volchenboum", "Junhan Zhao", "Siwei Chen", "Weiwen Jiang", "Qiang Guan" ]
[ "cs.ET" ]
[ "Computer Science" ]
2025-10-07T00:00:00
https://arxiv.org/abs/2510.06413
https://arxiv.org/pdf/2510.06413v1
2510.06413
10.48550/arXiv.2510.06413
0
0
false
null
arXiv.org
0.3266
bd93db712752904771ffc9457b5979fcaf5d6841220c1b7e758c14eea6542406
[ "arxiv", "semantic_scholar" ]
Attending on Multilevel Structure of Proteins enables Accurate Prediction of Cold-Start Drug-Target Interactions
Cold-start drug-target interaction (DTI) prediction focuses on interaction between novel drugs and proteins. Previous methods typically learn transferable interaction patterns between structures of drug and proteins to tackle it. However, insight from proteomics suggest that protein have multi-level structures and they...
[ "Ziying Zhang", "Yaqing Wang", "Yuxuan Sun", "Min Ye", "Quanming Yao" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2025-10-05T00:00:00
https://arxiv.org/abs/2510.04126
https://arxiv.org/pdf/2510.04126v1
2510.04126
10.48550/arXiv.2510.04126
0
0
false
null
arXiv.org
0.3243
997e330af66c5a44c97b0a05f0f23917a51a2ac6948203afda211d53201b5e66
[ "arxiv", "semantic_scholar" ]
Model Merging to Maintain Language-Only Performance in Developmentally Plausible Multimodal Models
State-of-the-art vision-and-language models consist of many parameters and learn from enormous datasets, surpassing the amounts of linguistic data that children are exposed to as they acquire a language. This paper presents our approach to the multimodal track of the BabyLM challenge addressing this discrepancy. We dev...
[ "Ece Takmaz", "Lisa Bylinina", "Jakub Dotlacil" ]
[ "cs.CL", "cs.CV" ]
[ "Computer Science" ]
2025-10-02T00:00:00
https://arxiv.org/abs/2510.01845
https://arxiv.org/pdf/2510.01845v1
2510.01845
10.48550/arXiv.2510.01845
1
0
false
null
null
0.2042
8aac8fc547a50e6f6816a05a13d9322940af5e1daf5af4043c434a5e9b506b40
[ "arxiv", "semantic_scholar" ]
Type-Less yet Type-Aware Inductive Link Prediction with Pretrained Language Models
Inductive link prediction is emerging as a key paradigm for real-world knowledge graphs (KGs), where new entities frequently appear and models must generalize to them without retraining. Predicting links in a KG faces the challenge of guessing previously unseen entities by leveraging generalizable node features such as...
[ "Alessandro De Bellis", "Salvatore Bufi", "Giovanni Servedio", "Vito Walter Anelli", "Tommaso Di Noia", "Eugenio Di Sciascio" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2025-09-30T00:00:00
https://arxiv.org/abs/2509.26224
https://arxiv.org/pdf/2509.26224v1
2509.26224
10.48550/arXiv.2509.26224
0
0
true
https://github.com/sisinflab/tyler
Conference on Empirical Methods in Natural Language Processing
0.4923
c68474d09149161b5097adb4aae09f1a6303eed62ff697027b51f0ce86025856
[ "arxiv", "semantic_scholar" ]
LAMP-PRo: Label-aware Attention for Multi-label Prediction of DNA- and RNA-binding Proteins using Protein Language Models
Identifying DNA- (DBPs) and RNA-binding proteins (RBPs) is crucial for the understanding of cell function, molecular interactions as well as regulatory functions. Owing to their high similarity, most of the existing approaches face challenges in differentiating between DBPs and RBPs leading to high cross-prediction err...
[ "Nimisha Ghosh", "Dheeran Sankaran", "Rahul Balakrishnan Adhi", "Sharath S", "Amrut Anand" ]
[ "q-bio.QM", "cs.AI", "cs.LG" ]
[ "Computer Science", "Biology" ]
2025-09-29T00:00:00
https://arxiv.org/abs/2509.24262
https://arxiv.org/pdf/2509.24262v2
2509.24262
10.48550/arXiv.2509.24262
0
0
true
https://github.com/NimishaGhosh/LAMP-PRo
arXiv.org
0.4905
60930b7601b2044af93819ee3ae0a1b7afd4c36d360c05d42914fcc934902aa8
[ "arxiv", "semantic_scholar" ]
Twin Peaks: Dual-Head Architecture for Structure-Free Prediction of Protein-Protein Binding Affinity and Mutation Effects
We present a novel dual-head deep learning architecture for protein-protein interaction modeling that enables simultaneous prediction of binding affinity ($Ξ”G$) and mutation-induced affinity changes ($ΔΔG$) using only protein sequence information. Our approach offers a significant advancement over existing methods by e...
[ "Supantha Dey", "Ratul Chowdhury" ]
[ "q-bio.QM" ]
[ "Biology" ]
2025-09-26T00:00:00
https://arxiv.org/abs/2509.22950
https://arxiv.org/pdf/2509.22950v1
2509.22950
null
1
0
false
null
null
0.1998
2bc1a481d3045b1f8b702408de30814fdca3d3fa1d01dbb18b974d3564addc64
[ "arxiv", "semantic_scholar" ]
Efficient Quantum Protein Structure Prediction with Problem-Agnostic Ansatzes
Accurately predicting protein structures from amino acid sequences remains a fundamental challenge in computational biology, with profound implications for understanding biological functions and enabling structure-based drug discovery. Quantum computing approaches based on coarse-grained lattice models combined with va...
[ "Hanna Linn", "Rui-Hao Li", "Alexander Holden", "Abdullah Ash Saki", "Frank DiFilippo", "Tomas Radivoyevitch", "Daniel Blankenberg", "Laura García-Álvarez", "Gâran Johansson" ]
[ "quant-ph" ]
[ "Physics" ]
2025-09-22T00:00:00
https://arxiv.org/abs/2509.18263
https://arxiv.org/pdf/2509.18263v1
2509.18263
null
1
0
false
null
null
0.1969
2ea56703821928365e5f4eac2439d5e2942c319b75b2a594a2e7de9a80b27a4d
[ "arxiv", "semantic_scholar" ]
From Prediction to Simulation: AlphaFold 3 as a Differentiable Framework for Structural Biology
AlphaFold 3 represents a transformative advancement in computational biology, enhancing protein structure prediction through novel multi-scale transformer architectures, biologically informed cross-attention mechanisms, and geometry-aware optimization strategies. These innovations dramatically improve predictive accura...
[ "Alireza Abbaszadeh", "Armita Shahlaee" ]
[ "q-bio.BM", "cs.LG" ]
[ "Computer Science", "Biology" ]
2025-08-25T00:00:00
https://arxiv.org/abs/2508.18446
https://arxiv.org/pdf/2508.18446v1
2508.18446
10.48550/arXiv.2508.18446
1
0
false
null
arXiv.org
0.2773
e022f1918a4154619461042e4a679001df53ea10cd5e186a91a4c4c279d51ba0
[ "arxiv", "semantic_scholar" ]
Deep Learning Model for Amyloidogenicity Prediction using a Pre-trained Protein LLM
The prediction of amyloidogenicity in peptides and proteins remains a focal point of ongoing bioinformatics. The crucial step in this field is to apply advanced computational methodologies. Many recent approaches to predicting amyloidogenicity within proteins are highly based on evolutionary motifs and the individual p...
[ "Zohra Yagoub", "Hafida Bouziane" ]
[ "cs.LG", "cs.AI", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2025-08-18T00:00:00
https://arxiv.org/abs/2508.12575
https://arxiv.org/pdf/2508.12575v1
2508.12575
10.2991/978-94-6463-805-9_22
1
0
false
null
arXiv.org
0.2693
7dece0cfbb92ef34733e5a16ae907e3ec336efaff4fadf467989600c0c44684c
[ "arxiv", "semantic_scholar" ]
Driving Accurate Allergen Prediction with Protein Language Models and Generalization-Focused Evaluation
Allergens, typically proteins capable of triggering adverse immune responses, represent a significant public health challenge. To accurately identify allergen proteins, we introduce Applm (Allergen Prediction with Protein Language Models), a computational framework that leverages the 100-billion parameter xTrimoPGLM pr...
[ "Brian Shing-Hei Wong", "Joshua Mincheol Kim", "Sin-Hang Fung", "Qing Xiong", "Kelvin Fu-Kiu Ao", "Junkang Wei", "Ran Wang", "Dan Michelle Wang", "Jingying Zhou", "Bo Feng", "Alfred Sze-Lok Cheng", "Kevin Y. Yip", "Stephen Kwok-Wing Tsui", "Qin Cao" ]
[ "cs.LG", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2025-08-14T00:00:00
https://arxiv.org/abs/2508.10541
https://arxiv.org/pdf/2508.10541v1
2508.10541
10.48550/arXiv.2508.10541
0
0
true
null
arXiv.org
0.4091
290803a475eeed7c71953073b94d51203d2339516da2e71e81a90fe36e9abf07
[ "arxiv", "semantic_scholar" ]
Energy-Based Models for Predicting Mutational Effects on Proteins
Predicting changes in binding free energy ($ΔΔG$) is a vital task in protein engineering and protein-protein interaction (PPI) engineering for drug discovery. Previous works have observed a high correlation between $ΔΔG$ and entropy, using probabilities of biologically important objects such as side chain angles and re...
[ "Patrick Soga", "Zhenyu Lei", "Yinhan He", "Camille Bilodeau", "Jundong Li" ]
[ "cs.LG" ]
[ "Computer Science" ]
2025-08-14T00:00:00
https://arxiv.org/abs/2508.10629
https://arxiv.org/pdf/2508.10629v1
2508.10629
10.1145/3711896.3736931
0
0
false
null
Knowledge Discovery and Data Mining
0.2647
e4b968583cd5dac10956364486238675088de6b7ce1db2a8194760db6512cef2
[ "arxiv", "semantic_scholar" ]
Not Yet AlphaFold for the Mind: Evaluating Centaur as a Synthetic Participant
Simulators have revolutionized scientific practice across the natural sciences. By generating data that reliably approximate real-world phenomena, they enable scientists to accelerate hypothesis testing and optimize experimental designs. This is perhaps best illustrated by AlphaFold, a Nobel-prize winning simulator in ...
[ "Sabrina Namazova", "Alessandra Brondetta", "Younes Strittmatter", "Matthew Nassar", "Sebastian Musslick" ]
[ "cs.LG", "cs.AI" ]
[ "Computer Science" ]
2025-08-11T00:00:00
https://arxiv.org/abs/2508.07887
https://arxiv.org/pdf/2508.07887v1
2508.07887
10.48550/arXiv.2508.07887
2
1
false
null
arXiv.org
0.2612
6bcbf04dbaa3032ba85de972916bafeace4d1a2244148b2740390bf53e49725b
[ "arxiv", "semantic_scholar" ]
Scaling and Data Saturation in Protein Language Models
Data in biology is redundant, noisy, and sparse. How does the type and scale of available data impact model performance? In this work, we specifically investigate how protein language models (pLMs) scale with increasing pretraining data. We investigate this relationship by measuring the performance of protein function ...
[ "Aviv Spinner", "Erika DeBenedictis", "Corey M. Hudson" ]
[ "q-bio.QM" ]
[ "Biology" ]
2025-07-29T00:00:00
https://arxiv.org/abs/2507.22210
https://arxiv.org/pdf/2507.22210v1
2507.22210
null
4
0
true
https://github.com/Align-to-Innovate/data-saturation-and-scaling
null
0.2911
a4bc9146f7a0426d9bce76a3696c3b193afce96a171c0a45f8d21791cbc16aeb
[ "arxiv", "semantic_scholar" ]
A novel language model for predicting serious adverse event results in clinical trials from their prospective registrations
Objectives: With accurate estimates of expected safety results, clinical trials could be better designed and monitored. We evaluated methods for predicting serious adverse event (SAE) results in clinical trials using information only from their registrations prior to the trial. Material and Methods: We analyzed 22,107 ...
[ "Qixuan Hu", "Xumou Zhang", "Jinman Kim", "Florence Bourgeois", "Adam G. Dunn" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2025-07-21T00:00:00
https://arxiv.org/abs/2507.22919
https://arxiv.org/pdf/2507.22919v2
2507.22919
10.48550/arXiv.2507.22919
1
0
false
null
arXiv.org
0.2372
dff613cd5afdfb5b33cc648ae472a565c46ecde7d7a36e62bcb42e8b00757bde
[ "arxiv", "semantic_scholar" ]
Continued domain-specific pre-training of protein language models for pMHC-I binding prediction
Predicting peptide--major histocompatibility complex I (pMHC-I) binding affinity remains challenging due to extreme allelic diversity ($\sim$30,000 HLA alleles), severe data scarcity for most alleles, and noisy experimental measurements. Current methods particularly struggle with underrepresented alleles and quantitati...
[ "Sergio E. Mares", "Ariel Espinoza Weinberger", "Nilah M. Ioannidis" ]
[ "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2025-07-16T00:00:00
https://arxiv.org/abs/2507.13077
https://arxiv.org/pdf/2507.13077v1
2507.13077
null
2
0
false
null
null
0.1473
615a089e8e1750031a63923f8b0581717f0d58295045bf2313c3d7b7766f3413
[ "arxiv", "semantic_scholar" ]
Conformation-Aware Structure Prediction of Antigen-Recognizing Immune Proteins
We introduce Ibex, a pan-immunoglobulin structure prediction model that achieves state-of-the-art accuracy in modeling the variable domains of antibodies, nanobodies, and T-cell receptors. Unlike previous approaches, Ibex explicitly distinguishes between bound and unbound protein conformations by training on labeled ap...
[ "FrΓ©dΓ©ric A. Dreyer", "Jan Ludwiczak", "Karolis Martinkus", "Brennan Abanades", "Robert G. Alberstein", "Pan Kessel", "Pranav Rao", "Jae Hyeon Lee", "Richard Bonneau", "Andrew M. Watkins", "Franziska Seeger" ]
[ "q-bio.BM", "cs.LG" ]
[ "Medicine", "Biology", "Computer Science" ]
2025-07-11T00:00:00
https://arxiv.org/abs/2507.09054
https://arxiv.org/pdf/2507.09054v1
2507.09054
10.1080/19420862.2025.2602217
6
1
true
https://github.com/prescient-design/ibex
mAbs
0.3489
85c60dba527fa4258ea2bfbeafd52499e3f6b46e5c68f5f2cb1560f8639e1815
[ "arxiv", "semantic_scholar" ]
PRING: Rethinking Protein-Protein Interaction Prediction from Pairs to Graphs
Deep learning-based computational methods have achieved promising results in predicting protein-protein interactions (PPIs). However, existing benchmarks predominantly focus on isolated pairwise evaluations, overlooking a model's capability to reconstruct biologically meaningful PPI networks, which is crucial for biolo...
[ "Xinzhe Zheng", "Hao Du", "Fanding Xu", "Jinzhe Li", "Zhiyuan Liu", "Wenkang Wang", "Tao Chen", "Wanli Ouyang", "Stan Z. Li", "Yan Lu", "Nanqing Dong", "Yang Zhang" ]
[ "cs.LG", "cs.AI", "q-bio.BM", "q-bio.MN" ]
[ "Computer Science", "Biology" ]
2025-07-07T00:00:00
https://arxiv.org/abs/2507.05101
https://arxiv.org/pdf/2507.05101v2
2507.05101
10.48550/arXiv.2507.05101
3
0
true
https://github.com/SophieSarceau/PRING
arXiv.org
0.3418
35416db0adec377947ad37adff664fc4425409a9b9b9c59febe15c247c6a8dee
[ "arxiv", "semantic_scholar" ]
ElliottAgents: A Natural Language-Driven Multi-Agent System for Stock Market Analysis and Prediction
This paper presents ElliottAgents, a multi-agent system leveraging natural language processing (NLP) and large language models (LLMs) to analyze complex stock market data. The system combines AI-driven analysis with the Elliott Wave Principle to generate human-comprehensible predictions and explanations. A key feature ...
[ "JarosΕ‚aw A. Chudziak", "MichaΕ‚ Wawer" ]
[ "cs.CE" ]
[ "Computer Science" ]
2025-07-04T00:00:00
https://arxiv.org/abs/2507.03435
https://arxiv.org/pdf/2507.03435v1
2507.03435
10.48550/arXiv.2507.03435
13
0
false
null
Pacific Asia Conference on Language, Information and Computation
0.2865
3f560b9c9b5d5696bdd8ef45f40c21973f45bc05886dd0a5b1b53c387d3b358d
[ "arxiv", "semantic_scholar" ]
DeSTA2.5-Audio: Toward General-Purpose Large Audio Language Model with Self-Generated Cross-Modal Alignment
We introduce DeSTA2.5-Audio, a general-purpose Large Audio Language Model (LALM) designed for robust auditory perception and instruction-following. Recent LALMs augment Large Language Models (LLMs) with auditory capabilities by training on large-scale audio-instruction datasets. However, existing LALMs have often suffe...
[ "Ke-Han Lu", "Zhehuai Chen", "Szu-Wei Fu", "Chao-Han Huck Yang", "Sung-Feng Huang", "Chih-Kai Yang", "Chee-En Yu", "Chun-Wei Chen", "Wei-Chih Chen", "Chien-yu Huang", "Yi-Cheng Lin", "Yu-Xiang Lin", "Chi-An Fu", "Chun-Yi Kuan", "Wenze Ren", "Xuanjun Chen", "Wei-Ping Huang", "En-Pei...
[ "eess.AS", "cs.CL", "cs.SD" ]
[ "Computer Science", "Engineering" ]
2025-07-03T00:00:00
https://arxiv.org/abs/2507.02768
https://arxiv.org/pdf/2507.02768v2
2507.02768
10.1109/TASLPRO.2026.3675792
50
4
true
https://github.com/kehanlu/DeSTA2.5-Audio
IEEE Transactions on Audio, Speech, and Language Processing
0.4269
837045204085ddf966e85102120ce95abc72efd910dd2e71936a2eba0e8aa5f9
[ "arxiv", "semantic_scholar" ]
Steering Protein Language Models
Protein Language Models (PLMs), pre-trained on extensive evolutionary data from natural proteins, have emerged as indispensable tools for protein design. While powerful, PLMs often struggle to produce proteins with precisely specified functionalities or properties due to inherent challenges in controlling their outputs...
[ "Long-Kai Huang", "Rongyi Zhu", "Bing He", "Jianhua Yao" ]
[ "q-bio.BM", "cs.LG" ]
[ "Computer Science", "Biology" ]
2025-07-01T00:00:00
https://arxiv.org/abs/2509.07983
https://arxiv.org/pdf/2509.07983v2
2509.07983
10.48550/arXiv.2509.07983
5
2
false
null
International Conference on Machine Learning
0.2386
992599a4c51365c71a416b8dffabf0fb43df0e7ad045cc9da447222ebe05dfa3
[ "arxiv", "semantic_scholar" ]
Self-Organizing Language
We introduce a novel paradigm of emergent local memory. It is a continuous-learning completely-parallel content-addressable memory encoding global order. It demonstrates how local constraints on uncoordinated learning can produce topologically protected memories realizing emergent symbolic order. It is therefore a neur...
[ "P. Myles Eugenio", "Anthony Beavers" ]
[ "cs.CL", "cs.AI", "cs.LG", "q-bio.NC" ]
[ "Computer Science", "Biology" ]
2025-06-29T00:00:00
https://arxiv.org/abs/2506.23293
https://arxiv.org/pdf/2506.23293v2
2506.23293
null
0
0
false
null
null
0.1349
bf2b044f029bcd29e9063502a72385ef42bc5cf61b03375789252548e1837e8d
[ "arxiv", "semantic_scholar" ]
Toward the Explainability of Protein Language Models
Protein language models (pLMs) excel in a variety of tasks that range from structure prediction to the design of functional enzymes. However, these models operate as black boxes, and their underlying working principles remain unclear. Here, we survey emerging applications of explainable artificial intelligence (XAI) to...
[ "Andrea Hunklinger", "Noelia Ferruz" ]
[ "q-bio.BM" ]
[ "Biology" ]
2025-06-24T00:00:00
https://arxiv.org/abs/2506.19532
https://arxiv.org/pdf/2506.19532v4
2506.19532
null
4
0
true
null
null
0.2437
1c0af367aabedb2a5100ab0033b2b6aeb96bc90576c2e3bece2c20ab078b17db
[ "arxiv", "semantic_scholar" ]
From Data to Knowledge: Evaluating How Efficiently Language Models Learn Facts
Sample efficiency is a crucial property of language models with practical implications for training efficiency. In real-world text, information follows a long-tailed distribution. Yet, we expect models to learn and recall frequent and infrequent facts. Sample-efficient models are better equipped to handle this challeng...
[ "Daniel Christoph", "Max Ploner", "Patrick Haller", "Alan Akbik" ]
[ "cs.CL", "cs.LG" ]
[ "Computer Science" ]
2025-06-20T00:00:00
https://arxiv.org/abs/2506.16912
https://arxiv.org/pdf/2506.16912v1
2506.16912
10.48550/arXiv.2506.16912
1
0
false
null
null
0.1283
01e833fed03679295d74a2882911ff3d0bf08674ae9161c795494815377140bf
[ "arxiv", "semantic_scholar" ]
PL-Guard: Benchmarking Language Model Safety for Polish
Despite increasing efforts to ensure the safety of large language models (LLMs), most existing safety assessments and moderation tools remain heavily biased toward English and other high-resource languages, leaving majority of global languages underexamined. To address this gap, we introduce a manually annotated benchm...
[ "Aleksandra KrasnodΔ™bska", "Karolina Seweryn", "Szymon Łukasik", "Wojciech Kusa" ]
[ "cs.CL" ]
[ "Computer Science" ]
2025-06-19T00:00:00
https://arxiv.org/abs/2506.16322
https://arxiv.org/pdf/2506.16322v1
2506.16322
10.48550/arXiv.2506.16322
2
0
false
null
null
0.1276
7b8ee46486dc765aaba8be750a85138fb4c60b5c22eff352a3cd190d5dc50a04
[ "arxiv", "semantic_scholar" ]
Can structural correspondences ground real world representational content in Large Language Models?
Large Language Models (LLMs) such as GPT-4 produce compelling responses to a wide range of prompts. But their representational capacities are uncertain. Many LLMs have no direct contact with extra-linguistic reality: their inputs, outputs and training data consist solely of text, raising the questions (1) can LLMs repr...
[ "Iwan Williams" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2025-06-19T00:00:00
https://arxiv.org/abs/2506.16370
https://arxiv.org/pdf/2506.16370v1
2506.16370
10.1111/mila.70018
6
1
false
null
Mind & Language (2026)
0.2113
75a55fff656c471766778a9e496b285ba5ba3581e9e1cab37cd1ff9bb027f2f0
[ "arxiv", "semantic_scholar" ]
DISPROTBENCH: Uncovering the Functional Limits of Protein Structure Prediction Models in Intrinsically Disordered Regions
Intrinsically disordered regions (IDRs) play central roles in cellular function, yet remain poorly evaluated by existing protein structure prediction benchmarks. Current evaluations largely focus on well-folded domains, overlooking three fundamental challenges in realistic biological settings: the structural complexity...
[ "Xinyue Zeng", "Tuo Wang", "Adithya Kulkarni", "Alexander Lu", "Alexandra Ni", "Phoebe Xing", "Junhan Zhao", "Siwei Chen", "Dawei Zhou" ]
[ "q-bio.BM", "cs.LG" ]
[ "Biology", "Computer Science" ]
2025-06-18T00:00:00
https://arxiv.org/abs/2507.02883
https://arxiv.org/pdf/2507.02883v2
2507.02883
null
1
0
true
https://github.com/Susan571/DisProtBench
null
0.2356
aedb9150be631477545f2e7296c2361e0785321ca04414fac3e3b31ad0a3f244
[ "arxiv", "semantic_scholar" ]
InstructPro: Natural Language Guided Ligand-Binding Protein Design
The de novo design of ligand-binding proteins with tailored functions is essential for advancing biotechnology and molecular medicine, yet existing AI approaches are limited by scarce protein-ligand complex data. To circumvent this data bottleneck, we leverage the abundant natural language descriptions characterizing p...
[ "Zhenqiao Song", "Ramith Hettiarachchi", "Chuan Li", "Jianwen Xie", "Lei Li" ]
[ "cs.LG", "cs.CE", "cs.CL" ]
[ "Computer Science" ]
2025-06-11T00:00:00
https://arxiv.org/abs/2506.09332
https://arxiv.org/pdf/2506.09332v3
2506.09332
null
4
1
false
null
null
0.1747
24ec0895e13954f36f7dc4f6657cc93c8536513335b13c531818dbc89383a157
[ "arxiv", "semantic_scholar" ]
BioLangFusion: Multimodal Fusion of DNA, mRNA, and Protein Language Models
We present BioLangFusion, a simple approach for integrating pre-trained DNA, mRNA, and protein language models into unified molecular representations. Motivated by the central dogma of molecular biology (information flow from gene to transcript to protein), we align per-modality embeddings at the biologically meaningfu...
[ "Amina Mollaysa", "Artem Moskale", "Pushpak Pati", "Tommaso Mansi", "Mangal Prakash", "Rui Liao" ]
[ "cs.LG" ]
[ "Computer Science" ]
2025-06-10T00:00:00
https://arxiv.org/abs/2506.08936
https://arxiv.org/pdf/2506.08936v1
2506.08936
10.48550/arXiv.2506.08936
4
1
false
null
arXiv.org
0.1902
9421819fef23fac9c08cb493a8b23e745d222e0dbeb894e66f36a485fdc7eaf2
[ "arxiv", "semantic_scholar" ]
AlphaFold Database Debiasing for Robust Inverse Folding
The AlphaFold Protein Structure Database (AFDB) offers unparalleled structural coverage at near-experimental accuracy, positioning it as a valuable resource for data-driven protein design. However, its direct use in training deep models that are sensitive to fine-grained atomic geometry, such as inverse folding, expose...
[ "Cheng Tan", "Zhenxiao Cao", "Zhangyang Gao", "Siyuan Li", "Yufei Huang", "Stan Z. Li" ]
[ "cs.LG", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2025-06-10T00:00:00
https://arxiv.org/abs/2506.08365
https://arxiv.org/pdf/2506.08365v1
2506.08365
10.48550/arXiv.2506.08365
2
0
false
null
arXiv.org
0.1902
b6f9da9b8836d99fefd98883d1732d2e02cc5ef600038430c9cd640a94a337c8
[ "arxiv", "semantic_scholar" ]
Into the Unknown: From Structure to Disorder in Protein Function Prediction
Intrinsically disordered regions (IDRs) account for one-third of the human proteome and play essential biological roles. However, predicting the functions of IDRs remains a major challenge due to their lack of stable structures, rapid sequence evolution, and context-dependent behavior. Many predictors of protein functi...
[ "Đesika KolariΔ‡", "Chi Fung Willis Chow", "Rita Zi Zhu", "Agnes Toth-Petroczy", "T. Reid Alderson", "Iva PritiΕ‘anac" ]
[ "q-bio.BM" ]
[ "Biology" ]
2025-06-06T00:00:00
https://arxiv.org/abs/2506.06004
https://arxiv.org/pdf/2506.06004v2
2506.06004
null
0
0
false
null
null
0.1181
177a284d804e1f6fd8193aa1754044be2fe8d467b2ef2b396b9ce295df9570d1
[ "arxiv", "semantic_scholar" ]
Multiscale guidance of protein structure prediction with heterogeneous cryo-EM data
Protein structure prediction models are now capable of generating accurate 3D structural hypotheses from sequence alone. However, they routinely fail to capture the conformational diversity of dynamic biomolecular complexes, often requiring heuristic MSA subsampling approaches for generating alternative states. In para...
[ "Rishwanth Raghu", "Axel Levy", "Gordon Wetzstein", "Ellen D. Zhong" ]
[ "cs.LG", "q-bio.BM" ]
[ "Computer Science", "Biology" ]
2025-06-04T00:00:00
https://arxiv.org/abs/2506.04490
https://arxiv.org/pdf/2506.04490v2
2506.04490
null
10
1
true
https://github.com/ml-struct-bio/cryoboltz
null
0.2603
541b8d667afef65e6b76a169bafb9914c98341ee055cde8e5622457859c6a733
[ "arxiv", "semantic_scholar" ]
Trajectory Prediction Meets Large Language Models: A Survey
Recent advances in large language models (LLMs) have sparked growing interest in integrating language-driven techniques into trajectory prediction. By leveraging their semantic and reasoning capabilities, LLMs are reshaping how autonomous systems perceive, model, and predict trajectories. This survey provides a compreh...
[ "Yi Xu", "Ruining Yang", "Yitian Zhang", "Jianglin Lu", "Mingyuan Zhang", "Yizhou Wang", "Lili Su", "Yun Fu" ]
[ "cs.CL", "cs.CV" ]
[ "Computer Science" ]
2025-06-03T00:00:00
https://arxiv.org/abs/2506.03408
https://arxiv.org/pdf/2506.03408v2
2506.03408
10.48550/arXiv.2506.03408
15
0
true
https://github.com/colorfulfuture/Awesome-Trajectory-Motion-Prediction-Papers
arXiv.org
0.301
d2584d7ddd76ec6b7043b482c64f9367d8ea70d3ba478faa9cb3446c0be966bb
[ "arxiv", "semantic_scholar" ]
Protein Language Model Zero-Shot Fitness Predictions are Improved by Inference-only Dropout
Protein Language Models (PLMs) such as ESM2 have been shown to be capable of zero-shot prediction of critical scalar properties of proteins (fitness). In this work, we show that injecting a dropout layer at inference time between a PLM's featurizer/embedding layer and its transformer, and averaging its output akin to M...
[ "Aditya Ravuri", "Neil D. Lawrence" ]
[ "cs.LG" ]
[ "Computer Science" ]
2025-05-31T00:00:00
https://arxiv.org/abs/2506.14793
https://arxiv.org/pdf/2506.14793v1
2506.14793
10.48550/arXiv.2506.14793
0
0
false
null
arXiv.org
0.1788
2e6bfe02b9c252b7da6e6a04262ddef85921fd4a3f74ec224c7399df50c2b55f
[ "arxiv", "semantic_scholar" ]
Aligning Proteins and Language: A Foundation Model for Protein Retrieval
This paper aims to retrieve proteins with similar structures and semantics from large-scale protein dataset, facilitating the functional interpretation of protein structures derived by structural determination methods like cryo-Electron Microscopy (cryo-EM). Motivated by the recent progress of vision-language models (V...
[ "Qifeng Wu", "Zhengzhe Liu", "Han Zhu", "Yizhou Zhao", "Daisuke Kihara", "Min Xu" ]
[ "q-bio.BM", "cs.AI", "cs.CE", "cs.CV", "cs.LG" ]
[ "Computer Science", "Biology" ]
2025-05-27T00:00:00
https://arxiv.org/abs/2506.08023
https://arxiv.org/pdf/2506.08023v1
2506.08023
10.48550/arXiv.2506.08023
1
0
false
null
arXiv.org
0.1742
add8b8512e20d5ecc2e9f9bbbc2767b3acb548b225aad58f3d9fa66911e73d79
[ "arxiv", "semantic_scholar" ]
AlphaFold's Bayesian Roots in Probability Kinematics
The seminal breakthrough of AlphaFold in protein structure prediction relied on a learned potential energy function parameterized by deep models, in contrast to its successors AlphaFold2 and AlphaFold3, which lack an explicit probabilistic interpretation. While AlphaFold's potential was originally justified by heuristi...
[ "Thomas Hamelryck", "Kanti V. Mardia" ]
[ "cs.LG" ]
[ "Computer Science" ]
2025-05-26T00:00:00
https://arxiv.org/abs/2505.19763
https://arxiv.org/pdf/2505.19763v3
2505.19763
null
2
0
false
null
null
0.1193
f90c949ade15ba2f4c9e0bd5e1fdeb023da3cf4dd97ba383fdfa8e6c1a128b9d
[ "arxiv", "semantic_scholar" ]
From Alignment to Advancement: Bootstrapping Audio-Language Alignment with Synthetic Data
Audio-aware large language models (ALLMs) have recently made great strides in understanding and processing audio inputs. These models are typically adapted from text-based large language models (LLMs) through additional training on audio-related tasks. This adaptation process presents two major limitations. First, ALLM...
[ "Chun-Yi Kuan", "Hung-yi Lee" ]
[ "eess.AS", "cs.AI", "cs.CL", "cs.LG", "cs.SD" ]
[ "Computer Science", "Engineering" ]
2025-05-26T00:00:00
https://arxiv.org/abs/2505.20166
https://arxiv.org/pdf/2505.20166v3
2505.20166
10.1109/TASLPRO.2025.3626233
4
0
false
null
IEEE Transactions on Audio, Speech, and Language Processing
0.1747
fc09c3be373f4e44bae269a7a4096faf762b965be76abf58376cdb758f052856
[ "arxiv", "semantic_scholar" ]
Prot2Token: A Unified Framework for Protein Modeling via Next-Token Prediction
The diverse nature of protein prediction tasks has traditionally necessitated specialized models, hindering the development of broadly applicable and computationally efficient Protein Language Models (PLMs). In this work, we introduce Prot2Token, a unified framework that overcomes these challenges by converting a wide ...
[ "Mahdi Pourmirzaei", "Farzaneh Esmaili", "Salhuldin Alqarghuli", "Mohammadreza Pourmirzaei", "Ye Han", "Kai Chen", "Mohsen Rezaei", "Duolin Wang", "Dong Xu" ]
[ "cs.LG", "q-bio.QM" ]
[ "Computer Science", "Biology" ]
2025-05-26T00:00:00
https://arxiv.org/abs/2505.20589
https://arxiv.org/pdf/2505.20589v2
2505.20589
10.48550/arXiv.2505.20589
4
0
true
https://github.com/mahdip72/prot2token
arXiv.org
0.2674
c3a06ff816af0f5fd2eb043768765ca7388db572603b0eb914ce8b4ddd548e6d
[ "arxiv", "semantic_scholar" ]
Rethinking Text-based Protein Understanding: Retrieval or LLM?
In recent years, protein-text models have gained significant attention for their potential in protein generation and understanding. Current approaches focus on integrating protein-related knowledge into large language models through continued pretraining and multi-modal alignment, enabling simultaneous comprehension of...
[ "Juntong Wu", "Zijing Liu", "He Cao", "Hao Li", "Bin Feng", "Zishan Shu", "Ke Yu", "Li Yuan", "Yu Li" ]
[ "cs.CL", "cs.AI" ]
[ "Computer Science" ]
2025-05-26T00:00:00
https://arxiv.org/abs/2505.20354
https://arxiv.org/pdf/2505.20354v4
2505.20354
10.48550/arXiv.2505.20354
7
0
true
https://github.com/IDEA-XL/RAPM
Conference on Empirical Methods in Natural Language Processing
0.2674
End of preview. Expand in Data Studio

Protein Language Models Papers β€” FineSet

A research-paper dataset on Protein Language Models Papers, assembled, deduplicated, and quality-scored by FineSet from arXiv and Semantic Scholar.

πŸ“Έ This is a dated snapshot β€” generated 2026-06-19. It is not auto-updated. Research on Protein Language Models Papers moves fast β€” new papers land on arXiv every week. Want this same dataset refreshed daily, on a topic you choose? See the bottom. ↓

Why this dataset

  • Quality-scored: quality_score float (0–1), blends citations with recency + code/venue signals β€” filter out the noise
  • Papers with code: 100 flagged via has_code β€” find reproducible work fast
  • Deduplicated: arXiv + Semantic Scholar cross-referenced, duplicate records merged
  • Clean JSONL: 408 records, one per line, normalized fields β€” no encoding garbage

Dataset details

  • Records: 408
  • Date range: 2019–2026
  • Snapshot date: 2026-06-19 (frozen β€” see note above)
  • Sources: arXiv, Semantic Scholar (cross-referenced, duplicates merged)
  • arXiv categories: cs.LG, q-bio.BM, q-bio.QM
  • Quality scoring: citations + recency + code/venue blend, 0–1 (p50=0.293, p90=0.511)
  • Format: JSONL, one record per line

Fields

Field Type Description
id string Deterministic SHA256 record id
sources list Which sources contributed (arxiv, semantic_scholar)
title string Paper title
abstract string Full abstract
authors list Author names
categories list arXiv category codes
fields_of_study list Semantic Scholar field tags
published_date string ISO 8601 date
url string arXiv abstract URL
pdf_url string|null Open-access PDF if available
arxiv_id string|null arXiv identifier
doi string|null DOI if available
citation_count int Citation count (Semantic Scholar)
influential_citation_count int Influential citations (Semantic Scholar)
has_code bool Code repo detected in the arXiv comment
code_url string|null GitHub URL if detected
venue string|null Publication venue
quality_score float 0–1, blended (citations + recency + code/venue)

Quality score methodology

quality_score = max(impact, freshness), clamped to [0, 1], where:

  • impact = max( log10(citations+1)/4 , log10(influential_citations+1)/2 ) β€” realized impact (0.5 at 100 citations, ~0.75 at 1,000, 1.0 at 10,000+).
  • freshness = recency Γ— (0.35 + 0.30Β·has_code + 0.20Β·has_venue) β€” a baseline for recent papers (so a strong paper published this week isn't scored 0 just for lacking citations), where recency is 1.0 for papers ≀60 days old and decays linearly to 0 by ~18 months.

Old highly-cited papers score on impact; brand-new papers score on freshness; old uncited papers score ~0. Useful for filtering training data by quality, not just age.

πŸ‘‰ Want this on YOUR topic, updated daily?

This snapshot is frozen at 2026-06-19. The live FineSet pipeline keeps a dataset like this refreshed every day on whatever topic you describe β€” new papers in, dedup and quality scoring automatic, export as JSONL/Parquet or push straight to the Hub.

Tell me the topic you'd want and I'll run the pipeline on it β€” open a discussion on this dataset, it's free and it's how I decide what to build next.

β†’ fineset.io β€” describe what you want to train on, get a dataset. Early-access waitlist open (referral skip available).

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