載入...
Conformation and Permeability: Cyclic Hexapeptide Diastereomers
Conformational ensembles of eight cyclic hexapeptide diastereomers in explicit cyclohexane, chloroform and water were analyzed by multicanonical molecular dynamics (McMD) simulations. Free energy landscapes (FELs) for each compound and solvent were obtained from the molecular shapes and principal co...
Na minha lista:
| 發表在: | J Chem Inf Model |
|---|---|
| Main Authors: | , , , , , |
| 格式: | Artigo |
| 語言: | Inglês |
| 出版: |
2019
|
| 主題: | |
| 在線閱讀: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7751304/ https://ncbi.nlm.nih.gov/pubmed/31042375 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.9b00217 |
| 標簽: |
添加標簽
沒有標簽, 成為第一個標記此記錄!
|