Interaction between Aromatic Residues. Molecular Dynamics and ab Initio Exploration of the Potential Energy Surface of the Tryptophan−Histidine Pair-Reference-Cited by-同舟云学术

Interaction between Aromatic Residues. Molecular Dynamics and ab Initio Exploration of the Potential Energy Surface of the Tryptophan−Histidine Pair

Published:2000-01-13 Issue:5 Volume:104 Page:1108-1114
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Gervasio Francesco Luigi¹,Procacci Piero¹,Cardini Gianni¹,Guarna Antonio²,Giolitti Alessandro³,Schettino Vincenzo¹

Affiliation:

1. Dipartimento di Chimica, Università di Firenze, Via Gino Capponi 9, I-50121 Firenze, Italy, and European Laboratory for Nonlinear Spectroscopy (LENS), Largo E. Fermi 2, I-50125 Firenze, Italy

2. Dipartimento di Chimica Organica “U.Schiff”, Università di Firenze, Via Gino Capponi 9, I-50121 Firenze, Italy

3. Dipartimento di Drug Design, Menarini Ricerche S.p.A., Via Sette Santi 3, I-50131 Firenze, Italy

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp992208g

Reference33 articles.

1. Transition Stateπ-Solvation by Aromatic Rings: An Electronic Contribution to Diels–Alder Reaction Diastereoselectivity

2. Potential Energy Surface for the Benzene Dimer. Results of ab Initio CCSD(T) Calculations Show Two Nearly Isoenergetic Structures: T-Shaped and Parallel-Displaced

3. The effect of Coulombic interactions on the calculated crystal structures of benzene at atmospheric and 25 kbar pressure

4. Uracil Dimer: Potential Energy and Free Energy Surfaces. Ab Initio beyond Hartree−Fock and Empirical Potential Studies

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