All-Atom Molecular Dynamic Simulations and Relative NMR Spectra Study of Weak C−H···O Contacts in Amide−Water Systems
Author:
Affiliation:
1. Department of Chemistry, Zhejiang University, Hangzhou 310027, People's Republic of China
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp044566b
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1. Role of Solvent in Determining Conformational Preferences of Alanine Dipeptide in Water
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3. Infrared Spectra of Amide Groups in α-Helical Proteins: Evidence for Hydrogen Bonding between Helices and Water
4. Secondary Structural Preferences of 2,2-Disubstituted Pyrrolidine-4-carboxylic Acid Oligomers: β-Peptide Foldamers that Cannot Form Internal Hydrogen Bonds
5. Control of Hairpin Formation via Proline Configuration in Parallel β-Sheet Model Systems
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