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Thomas R. Furlani

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2007
5EEMarek Freindorf, Matthew D. Jones, Yihan Shao, Jing Kong, Thomas R. Furlani: Large-Scale QM/MM Calculations of Electronic Excitations in Yellow Protein: Toward Petascale Level of Protein Calculations. BIBE 2007: 614-619
2006
4 Marek Freindorf, Yihan Shao, Jing Kong, Thomas R. Furlani: Combined QM/MM Studies of Binding Effect of Cytochrome P450cam to Putidaredoxin. BIOCOMP 2006: 391-398
2005
3EEMarek Freindorf, Yihan Shao, Thomas R. Furlani, Jing Kong: Lennard-Jones parameters for the combined QM/MM method using the B3LYP/6-31G*/AMBER potential. Journal of Computational Chemistry 26(12): 1270-1278 (2005)
2000
2EEJing Kong, Christopher A. White, Anna I. Krylov, David Sherrill, Ross D. Adamson, Thomas R. Furlani, Michael S. Lee, Aaron M. Lee, Steven R. Gwaltney, Terry R. Adams, Christian Ochsenfeld, Andrew T. B. Gilbert, Gary S. Kedziora, Vitaly A. Rassolov, David R. Maurice, Nikhil Nair, Yihan Shao, Nicholas A. Besley, Paul E. Maslen, Jeremy P. Dombroski, Holger Daschel, Weimin Zhang, Prakashan P. Korambath, Jon Baker, Edward F. C. Byrd, Troy A. Van Voorhis, Manabu Oumi, So Hirata, Chao-Ping Hsu, Naoto Ishikawa, Jan Florián, Arieh Warshel, Benny G. Johnson, Peter M. W. Gill, Martin Head-Gordon, John A. Pople: Q-Chem 2.0: a high-performance ab initio electronic structure program package. Journal of Computational Chemistry 21(16): 1532-1548 (2000)
1995
1 Thomas R. Furlani, Harry F. King: Implemenation of a Parallel Direct SCF Algorithm on Distributed Memory Computers. Journal of Computational Chemistry 16(1): 91-104 (1995)

Coauthor Index

1Terry R. Adams [2]
2Ross D. Adamson [2]
3Jon Baker [2]
4Nicholas A. Besley [2]
5Edward F. C. Byrd [2]
6Holger Daschel [2]
7Jeremy P. Dombroski [2]
8Jan Florián [2]
9Marek Freindorf [3] [4] [5]
10Andrew T. B. Gilbert [2]
11Peter M. W. Gill [2]
12Steven R. Gwaltney [2]
13Martin Head-Gordon [2]
14So Hirata [2]
15Chao-Ping Hsu [2]
16Naoto Ishikawa [2]
17Benny G. Johnson [2]
18Matthew D. Jones [5]
19Gary S. Kedziora [2]
20Harry F. King [1]
21Jing Kong [2] [3] [4] [5]
22Prakashan P. Korambath [2]
23Anna I. Krylov [2]
24Aaron M. Lee [2]
25Michael S. Lee [2]
26Paul E. Maslen [2]
27David R. Maurice [2]
28Nikhil Nair [2]
29Christian Ochsenfeld [2]
30Manabu Oumi [2]
31John A. Pople [2]
32Vitaly A. Rassolov [2]
33Yihan Shao [2] [3] [4] [5]
34David Sherrill [2]
35Troy A. Van Voorhis [2]
36Arieh Warshel [2]
37Christopher A. White [2]
38Weimin Zhang [2]

Colors in the list of coauthors

Copyright © Sun May 17 03:24:02 2009 by Michael Ley (ley@uni-trier.de)