mordred-descriptor /Mordred
Molecular descriptor calculation
Small molecules · Screening · workflows
★ 481 · Updated 2y ago · BSD-3
Molecular graphics rendering
The paper or list names a code repository. The repository itself was not opened.
Last commit 2026-08-13
The year the source list gave; the exact date was not checked.
mordred-descriptor /Mordred
Molecular descriptor calculation
★ 481 · Updated 2y ago · BSD-3
CDDLeiden /QSPRpred
QSPR/QSAR model building
★ 96 · Updated 6w ago · MIT
bioinf-jku /FCD : Fréchet ChemNet Distance
Molecular generative model quality metric
★ 91 · Updated 2y ago · LGPL-3
Post-processing workflow for generated molecules
★ 62 · Updated 3y ago · Apache
mqcomplab /NAMI
Chemical space visualization
★ 28 · Updated 2mo ago · MIT
slimeslab /ComProScanner
Composition-property data extraction from literature
★ 17 · Updated 2mo ago · MIT