Ab initio study of electronic interaction energies and desolvation energies for dopaminergic ligands in the catechol-O-methyltransferase active site
Authors:
- A. Katherine HatstatAHA. Katherine Hatstat
- Mallory MorrisMMMallory Morris
- Larryn W. PetersonLPLarryn W. Peterson
- Mauricio CafieroMCMauricio Cafiero
- 1 February 2016
- journal article
- research article
- Published by Elsevier in Computational and Theoretical Chemistry
- Vol. 1078, 146-162
Abstract
No abstract availableKeywords
Funding Information
- National Science Foundation (CHE-1229354)
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