A carregar...

Predicting binding affinity of CSAR ligands using both structure-based and ligand-based approaches

We report on the prediction accuracy of ligand-based (2D QSAR) and structure-based (MedusaDock) methods used both independently and in consensus for ranking the congeneric series of ligands binding to three protein targets (UK, ERK2, and CHK1) from the CSAR 2011 benchmark exercise. An ensemble of pr...

ver descrição completa

Na minha lista:
Detalhes bibliográficos
Main Authors: Fourches, Denis, Muratov, Eugene, Ding, Feng, Dokholyan, Nikolay V., Tropsha, Alexander
Formato: Artigo
Idioma:Inglês
Publicado em: 2013
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3779696/
https://ncbi.nlm.nih.gov/pubmed/23809015
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci400216q
Tags: Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!