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Simulation of Reversible Protein–Protein Binding and Calculation of Binding Free Energies Using Perturbed Distance Restraints
[Image: see text] Virtually all biological processes depend on the interaction between proteins at some point. The correct prediction of biomolecular binding free-energies has many interesting applications in both basic and applied pharmaceutical research. While recent advances in the field of molec...
Gardado en:
| Publicado en: | J Chem Theory Comput |
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| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
American
Chemical Society
2017
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| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5688412/ https://ncbi.nlm.nih.gov/pubmed/28898077 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jctc.7b00706 |
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