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Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets
2022-05-15
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2023-11-16T01:26:24Z
PROTACable is an end-to-end in-silico design toolkit for novel PROTACs
The Python software re-glycosylates protein structures using MD simulation results from the glycoshape database. It takes alphafold protein structures as input and outputs modified structures with gly...
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AutoDock for GPUs and other accelerators
#计算机科学#Implementation of the Confidence Bootstrapping procedure for protein-ligand docking.
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