Lanean...

Integrating docking scores and key interaction profiles to improve the accuracy of molecular docking: towards novel B-Raf(V600E) inhibitors

A set of ninety-eight B-Raf(V600E) inhibitors was used for the development of a molecular docking based QSAR model using linear and non-linear regression models. The integration of docking scores and key interaction profiles significantly improved the accuracy of the QSAR models, providing reasonabl...

Deskribapen osoa

Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:Medchemcomm
Egile Nagusiak: Hu, Chun-Qi, Li, Kang, Yao, Ting-Ting, Hu, Yong-Zhou, Ying, Hua-Zhou, Dong, Xiao-Wu
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: Royal Society of Chemistry 2017
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC6084233/
https://ncbi.nlm.nih.gov/pubmed/30108894
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c7md00229g
Etiketak: Etiketa erantsi
Etiketarik gabe, Izan zaitez lehena erregistro honi etiketa jartzen!