Interaction between Aromatic Residues. Molecular Dynamics and ab Initio Exploration of the Potential Energy Surface of the Tryptophan−Histidine Pair
- 13 January 2000
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry B
- Vol. 104 (5), 1108-1114
- https://doi.org/10.1021/jp992208g
Abstract
No abstract availableThis publication has 26 references indexed in Scilit:
- Uracil Dimer: Potential Energy and Free Energy Surfaces. Ab Initio beyond Hartree−Fock and Empirical Potential StudiesThe Journal of Physical Chemistry A, 1998
- Ab Initio Investigation of the Methylimidazole−Indole Complexes as Models of the Histidine−Tryptophan PairThe Journal of Physical Chemistry A, 1998
- All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of ProteinsThe Journal of Physical Chemistry B, 1998
- Comment on “Electron-Correlated Calculations of Electric Properties of Nucleic Acid Bases”The Journal of Physical Chemistry B, 1997
- Electron-Correlated Calculations of Electric Properties of Nucleic Acid BasesThe Journal of Physical Chemistry, 1996
- Structure and Properties of Benzene-Containing Molecular Clusters: Nonempirical ab Initio Calculations and ExperimentsChemical Reviews, 1994
- A well-behaved electrostatic potential based method using charge restraints for deriving atomic charges: the RESP modelThe Journal of Physical Chemistry, 1993
- Aromatic-Aromatic Interaction: A Mechanism of Protein Structure StabilizationScience, 1985
- Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular modelJournal of the American Chemical Society, 1985
- The effect of Coulombic interactions on the calculated crystal structures of benzene at atmospheric and 25 kbar pressureActa Crystallographica Section A Foundations and Advances, 1975