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Designing Well-Structured Cyclic Pentapeptides Based on Sequence–Structure Relationships

Cyclic peptides are a promising class of molecules for unique applications. Unfortunately, cyclic peptide design is severely limited by the difficulty in predicting the conformations they will adopt in solution. In this work, we use explicit-solvent molecular dynamics simulations to design well-stru...

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Detalhes bibliográficos
Publicado no:J Phys Chem B
Main Authors: Slough, Diana P., McHugh, Sean M., Cummings, Ashleigh E., Dai, Peng, Pentelute, Bradley L., Kritzer, Joshua A., Lin, Yu -Shan
Formato: Artigo
Idioma:Inglês
Publicado em: 2018
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6071411/
https://ncbi.nlm.nih.gov/pubmed/29589926
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.8b01747
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