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Using Quantum Mechanics to Improve Estimates of Amino Acid Side Chain Rotamer Energies
Amino acid side chains adopt a discrete set of favorable conformations typically referred to as rotamers. The relative energies of rotamers partially determine which side chain conformations are more often observed in protein structures and accurate estimates of these energies are important for pred...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
2008
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2680024/ https://ncbi.nlm.nih.gov/pubmed/18076032 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/prot.21845 |
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