Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular model MJS Dewar, EG Zoebisch, EF Healy, JJP Stewart Journal of the American Chemical Society 107 (13), 3902-3909, 1985 | 17783 | 1985 |
Location of transition states in reaction mechanisms MJS Dewar, EF Healy, JJP Stewart Journal of the Chemical Society, Faraday Transactions 2: Molecular and …, 1984 | 360 | 1984 |
Revised MNDO parameters for silicon MJS Dewar, EF Healy, JJP Stewart, J Friedheim, G Grady Organometallics 5 (2), 375-379, 1986 | 117 | 1986 |
Comments on a comparison of AM1 with the recently developed PM3 method MJS Dewar, EF Healy, AJ Holder, YC Yuan Journal of computational chemistry 11 (4), 541-542, 1990 | 102 | 1990 |
Ground states of molecules. 64.MNDO Calculations for compounds containing bromine MJS Dewar, E Healy Journal of computational chemistry 4 (4), 542-551, 1983 | 101 | 1983 |
Why life exists MJS Dewar, E Healy Organometallics 1 (12), 1705-1708, 1982 | 87 | 1982 |
Ground states of molecules. 68. MNDO study of the Claisen rearrangement MJS Dewar, EF Healy Journal of the American Chemical Society 106 (23), 7127-7131, 1984 | 83 | 1984 |
Ab initio study of the chair cope rearrangement of 1, 5-hexadiene MJS Dewar, EF Healy Chemical physics letters 141 (6), 521-524, 1987 | 74 | 1987 |
AM1: A New General Purpose Quantum Mechanical Molecular Model EG Zoebisch, EF Healy, JJ Stewart J. Am. Chem. Soc 107, 3902-3909, 1985 | 67 | 1985 |
Ground states of molecules. 73. MNDO calculations for compounds containing germanium MJS Dewar, GL Grady, EF Healy Organometallics 6 (1), 186-189, 1987 | 63 | 1987 |
Quantitative determination of DNA–ligand binding using fluorescence spectroscopy EF Healy Journal of chemical education 84 (8), 1304, 2007 | 62 | 2007 |
A docking study of L-chicoric acid with HIV-1 integrase EF Healy, J Sanders, PJ King, WE Robinson Jr Journal of Molecular Graphics and Modelling 27 (5), 584-589, 2009 | 61 | 2009 |
An evaluation of AM1 calculated vibrational frequencies EF Healy, A Holder Journal of Molecular Structure: THEOCHEM 281 (2-3), 141-156, 1993 | 42 | 1993 |
Mechanism of the 1, 5-sigmatropic hydrogen shift in 1, 3-pentadiene MJS Dewar, EF Healy, JM Ruiz Journal of the American Chemical Society 110 (8), 2666-2667, 1988 | 33 | 1988 |
An unusually large secondary deuterium isotope effect. Thermal trans-cis isomerization of trans-1-phenylcyclohexene RA Caldwell, H Misawa, EF Healy, MJS Dewar Journal of the American Chemical Society 109 (22), 6869-6870, 1987 | 29 | 1987 |
AM1 parameters for tin MJS Dewar, EF Healy, DR Kuhn, AJ Holder Organometallics 10 (2), 431-435, 1991 | 26 | 1991 |
A high level ab initio study of corner-protonated cyclopropane MJS Dewar, EF Healy, JM Ruiz Journal of the Chemical Society, Chemical Communications, 943-945, 1987 | 19 | 1987 |
A model for COVID-19-induced dysregulation of ACE2 shedding by ADAM17 EF Healy, M Lilic Biochemical and Biophysical Research Communications 573, 158-163, 2021 | 17 | 2021 |
Tyrosine kinase inhibition: Ligand binding and conformational change in c-Kit and c-Abl EF Healy, S Johnson, CR Hauser, PJ King FEBS letters 583 (17), 2899-2906, 2009 | 15 | 2009 |
Cruciaromaticity in organometallic compounds MJS Dewar, EF Healy, J Ruiz Pure and applied chemistry 58 (1), 67-74, 1986 | 14 | 1986 |