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790 积分 2023-02-06 加入
An open-source drug discovery platform enables ultra-large virtual screens
9天前
已完结
CosolvKit: a Versatile Tool for Cosolvent MD Preparation and Analysis
9天前
已完结
StreaMD: the toolkit for high-throughput molecular dynamics simulations
10天前
已完结
DeltaDock: A Unified Framework for Accurate, Efficient, and Physically Reliable Molecular Docking
21天前
已完结
molli: A General Purpose Python Toolkit for Combinatorial Small Molecule Library Generation, Manipulation, and Feature Extraction
22天前
已完结
FastTargetPred: a program enabling the fast prediction of putative protein targets for input chemical databases
26天前
已完结
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
26天前
已完结
MayaChemTools: An Open Source Package for Computational Drug Discovery
26天前
已完结
Communicative Representation Learning on Attributed Molecular Graphs
28天前
已完结
Communicative Representation Learning on Attributed Molecular Graphs
29天前
已完结
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