Cargando…

PyPLIF HIPPOS-Assisted Prediction of Molecular Determinants of Ligand Binding to Receptors

Identification of molecular determinants of receptor-ligand binding could significantly increase the quality of structure-based virtual screening protocols. In turn, drug design process, especially the fragment-based approaches, could benefit from the knowledge. Retrospective virtual screening campa...

Descripción completa

Detalles Bibliográficos
Autores principales: Istyastono, Enade P., Yuniarti, Nunung, Prasasty, Vivitri D., Mungkasi, Sudi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8122758/
https://www.ncbi.nlm.nih.gov/pubmed/33922338
http://dx.doi.org/10.3390/molecules26092452