科研项目详细信息
In silico insights into binding affinity and kinetics of small molecules binding to HSP90 or Pin1 | |
Westermaier Yvonne | |
Institution abroad - IACH | |
keywords:Structure- and fragment-based drug design; in silico binding affinity prediction; conformational plasticity; de novo ligand design; molecular dynamics; thermodynamic integration; free energy perturbation; steered molecular dynamics; heat shock protein 90 (HSP90); Peptidyl prolyl cis/trans isomerase (Pin1) | |
keywords: | |
Subject:化学(综合) | |
瑞士|英语 | |
2012至2012 | |
Source: 瑞士国家科学基金会 | |
Link: http://p3.snf.ch/Pages/DataAndDocumentation.aspx |