A carregar...
Computing the Free Energy along a Reaction Coordinate Using Rigid Body Dynamics
[Image: see text] The calculations of potential of mean force along complex chemical reactions or rare events pathways are of great interest because of their importance for many areas in chemistry, molecular biology, and material science. The major difficulty for free energy calculations comes from...
Na minha lista:
| Main Authors: | , , , , |
|---|---|
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
American
Chemical Society
2014
|
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4196739/ https://ncbi.nlm.nih.gov/pubmed/25328492 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct500342h |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|