Update data: 5 units
Browse files- legal/legal_dr_fees_01/base/software
- life_sciences/WGS_Variant_Calling/base/input
- life_sciences/amber_minimization_script_prep_instance_1/base/input
- life_sciences/amber_minimization_script_prep_instance_1/base/software
- life_sciences/amber_three_stage_mmgbsa_workflow_instance_1/base/input
- tasks/legal/legal_dr_fees_01/base/software/README.txt +1 -0
- tasks/legal/legal_dr_fees_01/base/software/python3.12 +3 -0
- tasks/life_sciences/amber_minimization_script_prep_instance_1/base/input/complex_structure.pdb +0 -0
- tasks/life_sciences/amber_minimization_script_prep_instance_1/base/software/README.md +23 -0
- tasks/life_sciences/amber_three_stage_mmgbsa_workflow_instance_1/base/input/complex_structure.pdb +0 -0
tasks/legal/legal_dr_fees_01/base/software/README.txt
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This task uses Python 3.12 and open-source PDF libraries. Stage 4 verifies software/python3.12.
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tasks/legal/legal_dr_fees_01/base/software/python3.12
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version https://git-lfs.github.com/spec/v1
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oid sha256:6055beb2f9c67330cea3f53c4e2252eeaa8d01d6e2689d47d35a58896aaec52e
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size 68
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tasks/life_sciences/amber_minimization_script_prep_instance_1/base/input/complex_structure.pdb
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tasks/life_sciences/amber_minimization_script_prep_instance_1/base/software/README.md
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# Software Notes — amber_minimization_script_prep_instance_1
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This benchmark is a parser-only Amber minimization workflow-construction task.
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The evaluated agent produces three text files under the task output directory:
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- `leap.in`
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- `step2_implicit.mini.mdin`
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- `submit_min.sh`
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It does not execute `tleap`, `pmemd.cuda`, `MMPBSA.py`, `sbatch`, or
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`nvidia-smi`. Amber 22, CUDA 11.6.2, and SLURM appear in the authored
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`submit_min.sh` as the intended target environment only; they are not
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benchmark-provided at solve time on this cpu-free-ubuntu VM.
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## Agent-facing runtime contract
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- Linux shell (bash)
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- Python 3.10 at `/usr/bin/python3`, also reachable via this folder as
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`software/python`
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- `uv` at `/usr/local/bin/uv` for evaluator-side tooling
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No other runtime is provisioned. Anything beyond the three text deliverables
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is out of scope for this task.
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tasks/life_sciences/amber_three_stage_mmgbsa_workflow_instance_1/base/input/complex_structure.pdb
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