Theoretical Studies on the Conformation of Protonated Dopamine in the Gas Phase and in Aqueous Solution
Author:
Affiliation:
1. Contribution from the Department of Medicinal and Biological Chemistry, The University of Toledo, Toledo, Ohio 43606-3390, and Istituto di Chimica Quantistica ed Energetica Molecolare del CNR, Via Risorgimento 35, I-56126 Pisa, Italy
Publisher
American Chemical Society (ACS)
Subject
Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis
Link
https://pubs.acs.org/doi/pdf/10.1021/ja981528v
Reference53 articles.
1. 3D QSAR in Drug Design; Kubinyi, H., Ed.; ESCOM: Leiden, 1993.
2. Conformational Study of Catecholamines in Solution
3. A computational study of solvent effects on the conformation of dopamine
4. General parameterized SCF model for free energies of solvation in aqueous solution
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