Solvation Free Energy as a Measure of Hydrophobicity: Application to Serine Protease Binding Interfaces-Reference-Cited by-同舟云学术

Solvation Free Energy as a Measure of Hydrophobicity: Application to Serine Protease Binding Interfaces

Published:2019-10-07 Issue:11 Volume:15 Page:5872-5882
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Kraml Johannes¹,Kamenik Anna S.¹,Waibl Franz¹,Schauperl Michael²^ORCID,Liedl Klaus R.¹^ORCID

Affiliation:

1. Institute of General, Inorganic and Theoretical Chemistry and Center for Molecular Biosciences Innsbruck (CMBI), University of Innsbruck, Innsbruck 6020, Austria

2. Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California, San Diego, La Jolla, California 92039-0736, United States

Funder

Austrian Science Fund

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

http://pubs.acs.org/doi/pdf/10.1021/acs.jctc.9b00742

Reference107 articles.

1. Interfaces and the driving force of hydrophobic assembly

2. A role for surface hydrophobicity in protein-protein recognition

3. Water Determines the Structure and Dynamics of Proteins

4. Free Volume and Entropy in Condensed Systems III. Entropy in Binary Liquid Mixtures; Partial Molal Entropy in Dilute Solutions; Structure and Thermodynamics in Aqueous Electrolytes

5. The Hydrophobic Effect Revisited-Studies with Supramolecular Complexes Imply High-Energy Water as a Noncovalent Driving Force

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