A carregar...

Quantum–mechanical property prediction of solvated drug molecules: what have we learned from a decade of SAMPL blind prediction challenges?

Joint academic–industrial projects supporting drug discovery are frequently pursued to deploy and benchmark cutting-edge methodical developments from academia in a real-world industrial environment at different scales. The dimensionality of tasks ranges from small molecule physicochemical property a...

ver descrição completa

Na minha lista:
Detalhes bibliográficos
Publicado no:J Comput Aided Mol Des
Main Authors: Tielker, Nicolas, Eberlein, Lukas, Hessler, Gerhard, Schmidt, K. Friedemann, Güssregen, Stefan, Kast, Stefan M.
Formato: Artigo
Idioma:Inglês
Publicado em: Springer International Publishing 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8018924/
https://ncbi.nlm.nih.gov/pubmed/33079358
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s10822-020-00347-5
Tags: Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!