genesistherapeutics Goto Github PK
Type: Organization
genesistherapeutics's Projects
grand
A Python module for carrying out GCMC insertions and deletions of water molecules in OpenMM.
latent-class-analysis
LCA implementation for python
mdtraj
An open library for the analysis of molecular dynamics trajectories
molstar
Molstar with modifications
openmm
OpenMM is a toolkit for molecular simulation using high performance GPU code.
paper-jtnn
Junction Tree Variational Autoencoder for Molecular Graph Generation (ICML 2018)
pmx
Toolkit for free-energy calculation setup/analysis and biomolecular structure handling
qcengine
Quantum chemistry program executor and IO standardizer (QCSchema).
tensorboard
TensorFlow's Visualization Toolkit
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