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grand
grand PublicForked from qyuan7/grand
A Python module for carrying out GCMC insertions and deletions of water molecules in OpenMM.
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REINVENT4
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openmm
openmm PublicForked from openmm/openmm
OpenMM is a toolkit for molecular simulation using high performance GPU code.
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OpenMM is a toolkit for molecular simulation using high performance GPU code.
cresset-group/openmm’s past year of commit activity - JabberDock Public Forked from audrius-kalpokas-cresset/JabberDock
protein docking using a density-based descriptor for atoms charge and dynamics
cresset-group/JabberDock’s past year of commit activity - REINVENT4 Public Forked from MolecularAI/REINVENT4
AI molecular design tool for de novo design, scaffold hopping, R-group replacement, linker design and molecule optimization.
cresset-group/REINVENT4’s past year of commit activity - dlib Public Forked from davisking/dlib
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cresset-group/dlib’s past year of commit activity - BioSimSpace Public Forked from michellab/BioSimSpace
Code and resources for the EPSRC BioSimSpace project.
cresset-group/BioSimSpace’s past year of commit activity
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