Extensive exploration of the conformational landscapes of neutral and terminally blocked prolines in the gas phase: A density functional theory study
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DOI: 10.1177/17475198221110480
Abstract: Proline is an important amino acid that plays unique roles in the structures of peptides and proteins. The conformations of proline are searched by a thorough method, generating 3888 trial structures optimized at the B97D/6-311++G**… read more here.
Keywords: conformational landscapes; neutral terminally; landscapes neutral; exploration conformational ... See more keywords