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Halgren, Thomas A.
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1

Identifying and Characterizing Binding Sites and Assessing ..:

Halgren, Thomas A.
Journal of Chemical Information and Modeling.  49 (2009)  2 - p. 377-389 , 2009
Link: https://doi.org/10.1021/..
 
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2

Extra Precision Glide:  Docking and Scoring Incorporating a..:

Friesner, Richard A. ; Murphy, Robert B. ; Repasky, Matthew P....
Journal of Medicinal Chemistry.  49 (2006)  21 - p. 6177-6196 , 2006
Link: https://doi.org/10.1021/..
 
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3

Integrated Modeling Program, Applied Chemical Theory (IMPAC..:

Banks, Jay L. ; Beard, Hege S. ; Cao, Yixiang...
Journal of Computational Chemistry.  26 (2005)  16 - p. 1752-1780 , 2005
Link: https://doi.org/10.1002/..
 
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4

A Polarizable Force Field and Continuum Solvation Methodolo..:

Maple, Jon R. ; Cao, Yixiang ; Damm, Wolfgang...
Journal of Chemical Theory and Computation.  1 (2005)  4 - p. 694-715 , 2005
Link: https://doi.org/10.1021/..
 
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5

Glide:  A New Approach for Rapid, Accurate Docking and Scor..:

Friesner, Richard A. ; Banks, Jay L. ; Murphy, Robert B....
Journal of Medicinal Chemistry.  47 (2004)  7 - p. 1739-1749 , 2004
Link: https://doi.org/10.1021/..
 
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6

Glide:  A New Approach for Rapid, Accurate Docking and Scor..:

Halgren, Thomas A. ; Murphy, Robert B. ; Friesner, Richard A....
Journal of Medicinal Chemistry.  47 (2004)  7 - p. 1750-1759 , 2004
Link: https://doi.org/10.1021/..
 
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7

Development of a polarizable force field for proteins via a..:

Kaminski, George A. ; Stern, Harry A. ; Berne, B. J....
Journal of Computational Chemistry.  23 (2002)  16 - p. 1515-1531 , 2002
Link: https://doi.org/10.1002/..
 
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8

Polarizable force fields:

Halgren, Thomas A ; Damm, Wolfgang
Current Opinion in Structural Biology.  11 (2001)  2 - p. 236-242 , 2001
Link: https://doi.org/10.1016/..
 
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9

Kinetics and Equilibrium Constants for Reactions of α-Pheny..:

Halgren, Thomas A. ; Roberts, John D. ; Horner, John H....
Journal of the American Chemical Society.  122 (2000)  13 - p. 2988-2994 , 2000
Link: https://doi.org/10.1021/..
 
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10

MMFF VII. Characterization of MMFF94, MMFF94s, and other wi..:

Halgren, Thomas A.
Journal of Computational Chemistry.  20 (1999)  7 - p. 730-748 , 1999
Link: https://doi.org/10.1002/..
 
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11

MMFF VI. MMFF94s option for energy minimization studies:

Halgren, Thomas A.
Journal of Computational Chemistry.  20 (1999)  7 - p. 720-729 , 1999
Link: https://doi.org/10.1002/..
 
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12

Consensus bond-charge increments fitted to electrostatic po..:

Bush, Bruce L. ; Bayly, Christopher I. ; Halgren, Thomas A.
Journal of Computational Chemistry.  20 (1999)  14 - p. 1495-1516 , 1999
Link: https://doi.org/10.1002/..
 
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13

Accurate ab Initio Quantum Chemical Determination of the Re..:

Beachy, Michael D. ; Chasman, David ; Murphy, Robert B...
Journal of the American Chemical Society.  119 (1997)  25 - p. 5908-5920 , 1997
Link: https://doi.org/10.1021/..
 
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14

A Priori Prediction of Activity for HIV-1 Protease Inhibito..:

Holloway, M. Katharine ; Wai, Jenny M. ; Halgren, Thomas A....
Journal of Medicinal Chemistry.  39 (1996)  11 - p. 2280-2280 , 1996
Link: https://doi.org/10.1021/..
 
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15

Calculation of molecular geometries, relative conformationa..:

St.‐Amant, Alain ; Cornell, Wendy D. ; Kollman, Peter A..
Journal of Computational Chemistry.  16 (1995)  12 - p. 1483-1506 , 1995
Link: https://doi.org/10.1002/..
 
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