E-LIB Suche - Ergebnisse für: Murphy, Robert B.

1

Reliable and Accurate Solution to the Induced Fit Docking P..:

Miller, Edward B. ; Murphy, Robert B. ; Sindhikara, Daniel...
Journal of Chemical Theory and Computation. 17 (2021) 4 - p. 2630-2639 , 2021

Link: https://doi.org/10.1021/..

2

WScore: A Flexible and Accurate Treatment of Explicit Water..:

Murphy, Robert B. ; Repasky, Matthew P. ; Greenwood, Jeremy R....
Journal of Medicinal Chemistry. 59 (2016) 9 - p. 4364-4384 , 2016

Link: https://doi.org/10.1021/..

3

Docking performance of the glide program as evaluated on th..:

Repasky, Matthew P. ; Murphy, Robert B. ; Banks, Jay L....
Journal of Computer-Aided Molecular Design. 26 (2012) 6 - p. 787-799 , 2012

Link: https://doi.org/10.1007/..

4

ConfGen: A Conformational Search Method for Efficient Gener..:

Watts, K. Shawn ; Dalal, Pranav ; Murphy, Robert B....
Journal of Chemical Information and Modeling. 50 (2010) 4 - p. 534-546 , 2010

Link: https://doi.org/10.1021/..

5

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/..

6

Pseudospectral Local Second-Order Møller−Plesset Methods fo..:

Kaminski, George A. ; Maple, Jon R. ; Murphy, Robert B...
Journal of Chemical Theory and Computation. 1 (2005) 2 - p. 248-254 , 2005

Link: https://doi.org/10.1021/..

7

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/..

8

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/..

9

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/..

10

Calculation of atomization energies by a multiconfiguration..:

Dunietz, Barry D. ; Murphy, Robert B. ; Friesner, Richard A.
The Journal of Chemical Physics. 110 (1999) 4 - p. 1921-1930 , 1999

Link: https://doi.org/10.1063/..

11

Correlated ab Initio Electronic Structure Calculations for ..:

Friesner, Richard A. ; Murphy, Robert B. ; Beachy, Michael D....
The Journal of Physical Chemistry A. 103 (1999) 13 - p. 1913-1928 , 1999

Link: https://doi.org/10.1021/..

12

Parallel pseudospectral electronic structure: II. Localized..:

Beachy, Michael D. ; Chasman, David ; Friesner, Richard A..
Journal of Computational Chemistry. 19 (1998) 9 - p. 1030-1038 , 1998

Link: https://doi.org/10.1002/..

13

Accurate quantum chemical calculation of the relative energ..:

Murphy, Robert B ; Friesner, Richard A
Chemical Physics Letters. 288 (1998) 2-4 - p. 403-407 , 1998

Link: https://doi.org/10.1016/..

14

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/..

15

Pseudospectral localized generalized Mo/ller–Plesset method..:

Murphy, Robert B. ; Pollard, W. Thomas ; Friesner, Richard A.
The Journal of Chemical Physics. 106 (1997) 12 - p. 5073-5084 , 1997

Link: https://doi.org/10.1063/..