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An Optimized Charge Penetration Model for Use with the AMOEBA Force Field
The principal challenge of using classical physics to model biomolecular interactions is capturing the nature of short-range interactions that drive biological processes from nucleic acid base stacking to protein-ligand binding. In particular most classical force fields suffer from an error in their...
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| Gepubliceerd in: | Phys Chem Chem Phys |
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| Hoofdauteurs: | , , , , , |
| Formaat: | Artigo |
| Taal: | Inglês |
| Gepubliceerd in: |
2016
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| Onderwerpen: | |
| Online toegang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5177509/ https://ncbi.nlm.nih.gov/pubmed/27901142 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1039/c6cp06017j |
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