Toward a Molecular Dynamics Force Field for Simulations of 40% Trifluoroethanol–Water
Author:
Affiliation:
1. Department of Chemistry and Biochemistry, University of California, Santa Barbara, Santa Barbara, California 93106, United States
Funder
NSF Office of the Director
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/jp408879g
Reference76 articles.
1. Trifluoroethanol and colleagues: cosolvents come of age. Recent studies with peptides and proteins
2. Structural characterization of the model amphipathic peptide Ac-LKKLLKLLKKLLKL-NH2 in aqueous solution and with 2,2,2-trifluoroethanol and 1,1,1,3,3,3-hexafluoroisopropanol
3. Trifluoroethanol-induced conformational change of tetrameric and monomeric soybean agglutinin: Role of structural organization and implication for protein folding and stability
4. Truncation of a β-Barrel Scaffold Dissociates Intrinsic Stability from Its Propensity to Aggregation
5. Structure of hen egg-white lysozyme solvated in TFE/water: a molecular dynamics simulation study based on NMR data
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