Bridging Calorimetry and Simulation through Precise Calculations of Cucurbituril–Guest Binding Enthalpies-Reference-Cited by-同舟云学术

Bridging Calorimetry and Simulation through Precise Calculations of Cucurbituril–Guest Binding Enthalpies

Published:2014-08-01 Issue:9 Volume:10 Page:4069-4078
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Fenley Andrew T.¹,Henriksen Niel M.¹,Muddana Hari S.¹,Gilson Michael K.¹

Affiliation:

1. Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California San Diego, 9500 Gilman Drive, La Jolla, California 92093-0736, United States

Funder

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct5004109

Reference81 articles.

1. Rapid measurement of binding constants and heats of binding using a new titration calorimeter

2. Understanding Binding Affinity: A Combined Isothermal Titration Calorimetry/Molecular Dynamics Study of the Binding of a Series of Hydrophobically Modified Benzamidinium Chloride Inhibitors to Trypsin

3. A Medicinal Chemist’s Guide to Molecular Interactions

4. Thermodynamics of Ligand Binding and Efficiency

5. ITC in the post-genomic era…? Priceless

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