RMeli / spyrmsd Star 75 Code Issues Pull requests Discussions 📐 Symmetry-corrected RMSD in Python computational-biology computational-chemistry drug-discovery docking symmetry rmsd cadd molecular-docking computer-aided-drug-design Updated Jun 23, 2024 Python
UnixJunkie / FASMIFRA Star 47 Code Issues Pull requests Molecular Generation by Fast Assembly of SMILES Fragments smiles cadd molecular-generation distribution-matching molecular-fragments deepsmiles Updated Nov 27, 2023 Python
CyberCatQ / pyCADD Star 27 Code Issues Pull requests A python package for computer-aid drug design. python molecular-dynamics ambermd schrodinger cadd computer-aid-drug-design Updated Jun 13, 2024 Python
filipsPL / CADD-PW Star 11 Code Issues Pull requests Discussions Computer Aided Drug Design / Komputerowe Wsparcie Projektowania Leków knime pymol drug-discovery marvin drug-design cadd leki Updated Jan 2, 2024 Python
wAnnotate / webAnnotate Star 2 Code Issues Pull requests Annotates VCF files with data from public databases such as Ensembl, COSMIC, CiViC, etc. annotation civic mutation vcf ncbi cosmic cadd Updated Mar 11, 2022 Python
lm-ut / CADD_summary Star 0 Code Issues Pull requests Python script providing summary of CADD scores conditioned on several options python vep cadd Updated Sep 27, 2023 Python