OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research
Repository Index
47,133 repositories indexed
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Universal cheminformatics toolkit, utilities and database search tools
- indigo
- bingo
- cheminformatics
- chemistry
The d-SEAMS C++ core engine
- molecular-dynamics-simulation
- molecular-dynamics
- trajectory-analysis
- lua
Accelerated similarity searching of small molecules (bioconductor package)