Chargement en cours...

Explainable Deep Relational Networks for Predicting Compound–Protein Affinities and Contacts

Predicting compound–protein affinity is beneficial for accelerating drug discovery. Doing so without the often-unavailable structure data is gaining interest. However, recent progress in structure-free affinity prediction, made by machine learning, focuses on accuracy but leaves much to be desired f...

Description complète

Enregistré dans:
Détails bibliographiques
Publié dans:J Chem Inf Model
Auteurs principaux: Karimi, Mostafa, Wu, Di, Wang, Zhangyang, Shen, Yang
Format: Artigo
Langue:Inglês
Publié: 2020
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC7987499/
https://ncbi.nlm.nih.gov/pubmed/33347301
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.0c00866
Tags: Ajouter un tag
Pas de tags, Soyez le premier à ajouter un tag!