Cargando…
Markov-State Transition Path Analysis of Electrostatic Channeling
[Image: see text] Electrostatic channeling is a naturally occurring approach to control the flux of charged intermediates in catalytic cascades. Computational techniques have enabled quantitative understanding of such mechanisms, augmenting experimental approaches by modeling molecular interactions...
| Autores principales: | , , , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2019
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6602406/ https://www.ncbi.nlm.nih.gov/pubmed/31275507 http://dx.doi.org/10.1021/acs.jpcc.9b02844 |