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Polarizable Atomic Multipole Solutes in a Generalized Kirkwood Continuum
The generalized Born (GB) model of continuum electrostatics is an analytic approximation to the Poisson equation useful for predicting the electrostatic component of the solvation free energy for solutes ranging in size from small organic molecules to large macromolecular complexes. This work presen...
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| Udgivet i: | J Chem Theory Comput |
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| Main Authors: | , |
| Format: | Artigo |
| Sprog: | Inglês |
| Udgivet: |
2007
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| Fag: | |
| Online adgang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4767294/ https://ncbi.nlm.nih.gov/pubmed/26636202 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct7001336 |
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