Consensus scoring for ligand/protein interactions RD Clark, A Strizhev, JM Leonard, JF Blake, JB Matthew
Journal of Molecular Graphics and Modelling 20 (4), 281-295, 2002
551 2002 Validating models based on large data sets RD Clark, DG Sprous, JM Leonard
Rational approaches to drug design, 475-485, 2001
57 2001 Quadratically convergent calculation of localized molecular orbitals JM Leonard, WL Luken
Theoretica chimica acta 62, 107-132, 1982
49 1982 Theoretical predictions of structures and vibrational infrared frequencies. I. Mercaptans and sulfides HF Hameka, SL Emery, GR Famini, JO Jensen, JM Leonard, DJ Reutter
Phosphorus, Sulfur, and Silicon and the Related Elements 53 (1-4), 373-388, 1990
24 1990 A User's Guide to the Molecular Modeling, Analysis, and Display-System (MMADS) JM Leonard, GR Famini, ...
CRDEC-TR-86039, US Army Chemical Research, Development and Engineering …, 1986
23 1986 Rational Approaches to Drug Design RD Clark, DG Sprous, JM Leonard
Holtje, HD, 475, 2001
19 2001 OptiDock: virtual HTS of combinatorial libraries by efficient sampling of binding modes in product space DG Sprous, DR Lowis, JM Leonard, T Heritage, SN Burkett, DS Baker, ...
Journal of combinatorial chemistry 6 (4), 530-539, 2004
17 2004 Molecular mechanics parameterization: Bond lengths and angles for nitrogen and phosphorus containing compounds JM Leonard, WP Ashman
Journal of computational chemistry 11 (8), 952-957, 1990
16 1990 Calculation of localized molecular orbitals JM Leonard, WL Luken
International journal of quantum chemistry 25 (2), 355-365, 1984
13 1984 Auger energies for boron atomic ions based on the saddle-point variational methodWL Luken, JM Leonard
Physical Review A 28 (2), 532, 1983
11 1983 The effects of biasing torsional mutations in a conformational GA A Strizhev, EJ Abrahamian, S Choi, JM Leonard, PRN Wolohan, RD Clark
Journal of chemical information and modeling 46 (4), 1862-1870, 2006
8 2006 Application of the saddle‐point variational method to self‐consistent‐field wave functions WL Luken, JM Leonard, JC Culberson
International Journal of Quantum Chemistry 24 (S17), 401-405, 1983
8 1983 Pharmacophore models and comparative molecular field analysis (CoMFA) RD Clark, JM Leonard, A Strizhev
Pharmacophore Perception, Development, and Use in Drug Design, 151-169, 2000
6 2000 Blake by Universidade Federal de Minas Gerais on 09/30/11. For personal use only. JF, Matthew JB. 2002. Consensus scoring for ligand/protein interactions RD Clark, A Strizhev, JM Leonard
J. Mol. Graph 20, 281-95, 0
5 Docking combinatorial libraries efficiently using FLEXX. D Sprous, R Clark, D Lowis, J Leonard, T Heritage
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 222, U388-U388, 2001
2 2001 Chemical application of the saddle point variational method. I. Oxygen 1s vacancy ions of formaldehyde WL Luken, JC Culberson, JM Leonard
The Journal of chemical physics 80 (9), 4320-4324, 1984
2 1984 Assessing the quality of virtual screening results for combinatorial libraries. DG Sprous, RD Clark, JM Leonard, TW Heritage
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 224, U344-U344, 2002
1 2002 Comptational methods in fragment-based drug design C Williams, JM Leonard
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 243, 2012
2012 Effects of Callosotomy on Nasotemporal Smooth Pursuit in Macaque Monkey: Validating a Cerebral Gaze Asymmetry Mechanism L Tychsen, D Sarezky, J Leonard, P Foeller
Investigative Ophthalmology & Visual Science 50 (13), 2874-2874, 2009
2009 Good BREEDing, techniques for generating hybrid molecules JM Leonard
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 237, 2009
2009