Structure-based drug design, fragment discovery, and molecular modeling.
Pinned Loading
-
frase_rich
frase_rich PublicWeighted FRASE triplet fingerprints for fragment retrieval in protein pockets
Python
-
epitope_clustering
epitope_clustering PublicStructural bioinformatics pipeline for clustering antibody-antigen epitopes by geometric similarity and deriving consensus paratope design constraints for antibody engineering.
Python
-
pocketfield
pocketfield PublicProbe-based spherical interaction fields for pocket-conditioned molecule generation.
Python 1
Something went wrong, please refresh the page to try again.
If the problem persists, check the GitHub status page or contact support.
If the problem persists, check the GitHub status page or contact support.