BioinformaticsJournal of Chemical Information and ModelingPeer-reviewed
PP-MAPS: dynamic pharmacophore signatures of protein-peptide interfaces from molecular dynamics trajectories
Camille Depenveiller, Arezki Guerda, Emilia Rabia…·Matthieu Montès
PP-MAPS extracts dynamic pharmacophore signatures from MD trajectories of protein-peptide complexes to analyze interactions and compare peptides and binding sites.
DOI 10.1021/acs.jcim.6c00605