First-Principles Calculation of the Intrinsic Aqueous Solubility of Crystalline Druglike Molecules-Reference-Cited by-同舟云学术

First-Principles Calculation of the Intrinsic Aqueous Solubility of Crystalline Druglike Molecules

Published:2012-08-09 Issue:9 Volume:8 Page:3322-3337
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Palmer David S.¹²,McDonagh James L.³,Mitchell John B. O.³,van Mourik Tanja³,Fedorov Maxim V.¹²

Affiliation:

1. Department of Physics, University of Strathclyde, John Anderson Building, 107 Rottenrow, Glasgow, Scotland G4 0NG, United Kingdom

2. Max Planck Institute for Mathematics in the Sciences, Inselstrasse 22, DE-04103 Leipzig, Germany

3. Biomedical Sciences Research Complex and EaStCHEM School of Chemistry, University of St. Andrews, Purdie Building, North Haugh, St. Andrews, Scotland KY16 9ST, United Kingdom

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct300345m

Reference118 articles.

1. Absorption and Drug Development

2. THE RATE OF SOLUTION OF SOLID SUBSTANCES IN THEIR OWN SOLUTIONS.

3. CONCERNING THE RELATIONSHIP BETWEEN THE STRENGTH OF ACIDS AND THEIR CAPACITY TO PRESERVE NEUTRALITY

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