Toward the Classical Description of Halogen Bonds: A Quantum Based Generalized Empirical Potential for Fluorine, Chlorine, and Bromine
Author:
Affiliation:
1. Department of Chemistry, Federal University of Lavras, CEP 37200-000 Lavras, Minas Gerais, Brazil
2. Center for Basic and Applied Research, University Hradec Kralove, Hradec Kralove, Czech Republic
Funder
Funda??o de Amparo ? Pesquisa do Estado de Minas Gerais
Conselho Nacional de Desenvolvimento Cient?fico e Tecnol?gico
Coordena??o de Aperfei?oamento de Pessoal de N?vel Superior
Excellence project FIM
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.6b13112
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1. Discovery of VX-509 (Decernotinib): A Potent and Selective Janus Kinase 3 Inhibitor for the Treatment of Autoimmune Diseases
2. Enthalpy–Entropy Compensation in Biomolecular Halogen Bonds Measured in DNA Junctions
3. Effects of fluorines on nonsecosteroidal vitamin D receptor agonists
4. Halogen bonds in biological molecules
5. Halogen Bonding—A Novel Interaction for Rational Drug Design?
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