Conformational studies of (S)idazoxan and (S)methoxyidazoxan usingAM1 andPM3 semiempirical molecular orbital methods
- 5 September 1992
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 44 (2) , 181-202
- https://doi.org/10.1002/qua.560440208
Abstract
No abstract availableKeywords
This publication has 15 references indexed in Scilit:
- PM3 study of the proton affinities of 2‐, 3‐, and 4‐monosubstituted pyridines in the gas phaseJournal of Computational Chemistry, 1991
- A comparison of conformational energies calculated by molecular mechanics (MM2(85), Sybyl 5.1, Sybyl 5.21, and ChemX) and semiempirical (AM1 and PM3) methodsJournal of Computational Chemistry, 1991
- Comparison of semiempirical MO methods applied to large moleculesJournal of Computational Chemistry, 1991
- Computer modeling of the interactions of complex moleculesAccounts of Chemical Research, 1990
- Optimization of parameters for semiempirical methods I. MethodJournal of Computational Chemistry, 1989
- Structure of the Adrenergic and Related ReceptorsAnnual Review of Neuroscience, 1989
- Using shape complementarity as an initial screen in designing ligands for a receptor binding site of known three-dimensional structureJournal of Medicinal Chemistry, 1988
- alpha-2 Adrenergic ReceptorsPublished by Springer Nature ,1988
- Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular modelJournal of the American Chemical Society, 1985
- Ground states of molecules. 38. The MNDO method. Approximations and parametersJournal of the American Chemical Society, 1977