Perspectives on High-Throughput Ligand/Protein Docking With Martini MD Simulations

Lunedì 29 marzo 2021 circa 1 minuti di lettura

Journal and Affiliations:

Frontiers in Molecular Biosciences, 29 marzo 2021

Vittorio Limongelli, Istituto di Scienze computazionali, Facoltà di Scienze biomediche, USI, Lugano

Tags:
coarse-grain
drug design
dynamic docking
high-throughput screening
ligand-protein
Martini
molecular dynamics
protein-protein interaction
Authors:
Vittorio Limongelli
Link: https://www.frontiersin.org/articles/10.3389/fmolb.2021.657222/full