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Physics-based potentials for the coupling between backbone- and side-chain-local conformational states in the united residue (UNRES) force field for protein simulations
The UNited RESidue (UNRES) model of polypeptide chains is a coarse-grained model in which each amino-acid residue is reduced to two interaction sites, namely a united peptide group (p) located halfway between the two neighboring α-carbon atoms (C(α)s), which serve only as geometrical points, and a u...
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| Foilsithe in: | J Chem Theory Comput |
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| Main Authors: | , , , , |
| Formáid: | Artigo |
| Teanga: | Inglês |
| Foilsithe: |
2015
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| Ábhair: | |
| Rochtain Ar Líne: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4327884/ https://ncbi.nlm.nih.gov/pubmed/25691834 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct500736a |
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