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OneScience-Sugon
/
DiffDock
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English
OneScience
protein-ligand molecular docking
generative
License:
mit
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DiffDock
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1 commit
anzhi2710gmailcom
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__pycache__
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__init__.py
13 Bytes
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evaluate.py
92 Bytes
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infer.sh
4.88 kB
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infer_slurm.sbatch
554 Bytes
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sample_diffdock.py
15.1 kB
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train.sh
6.92 kB
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train_demo.sh
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train_diffdock.py
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train_slurm.sbatch
566 Bytes
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