The official sources for the RDKit library
- cheminformatics
- c-plus-plus
- python
- rdkit
47,133 repositories indexed
1–5 of 5 · Most stars
The official sources for the RDKit library
Gazebo database of SDF models. This is a predecessor to https://app.gazebosim.org
Native R and Python sample-deletion robustness for omics: candidate certificates, minimum deletion bounds, Bioconductor model refits and donor-level pseudobulk
TranslatedAntifouling coating evidence panel: formulation sandbox, route biofouling stress, literature bounds. Simulation ≠ measurement. Live: https://simulator.jassyhong.top
Simple webapp for generating small ligand conformers