Loading...
Quantum and Molecular Mechanical (QM/MM) Monte Carlo Techniques for Modeling Condensed-Phase Reactions
A recent review (Acc. Chem. Res. 2010, 43:142–151) examined our use and development of a combined quantum and molecular mechanical (QM/MM) technique for modelling organic and enzymatic reactions. Advances included the PDDG/PM3 semiempirical QM (SQM) method, computation of multi-dimensional potential...
Na minha lista:
| Udgivet i: | Wiley Interdiscip Rev Comput Mol Sci |
|---|---|
| Main Authors: | , |
| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
2014
|
| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4242105/ https://ncbi.nlm.nih.gov/pubmed/25431625 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/wcms.1180 |
| Tags: |
Tilføj Tag
Ingen Tags, Vær først til at tagge denne postø!
|