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Polarizable Simulations with Second order Interaction Model (POSSIM) force field: Developing parameters for alanine peptides and protein backbone

A previously introduced POSSIM (POlarizable Simulations with Second order Interaction Model) force field has been extended to include parameters for alanine peptides and protein backbones. New features were introduced into the fitting protocol, as compared to the previous generation of the polarizab...

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書誌詳細
主要な著者: Ponomarev, Sergei Y., Kaminski, George A.
フォーマット: Artigo
言語:Inglês
出版事項: 2011
主題:
オンライン・アクセス:https://ncbi.nlm.nih.gov/pmc/articles/PMC3129858/
https://ncbi.nlm.nih.gov/pubmed/21743799
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct1007197
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