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Publications of Author

1. Marek Freindorf, Yihan Shao, Jing Kong, Thomas R. Furlani
   Combined QM/MM Studies of Binding Effect of Cytochrome P450cam to Putidaredoxin. [Citation Graph (0, 0)][DBLP]
   BIOCOMP, 2006, pp:391-398 [Conf]
   
2. Thomas R. Furlani, Harry F. King
   Implemenation of a Parallel Direct SCF Algorithm on Distributed Memory Computers. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1995, v:16, n:1, pp:91-104 [Journal]
   
3. Jing 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. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2000, v:21, n:16, pp:1532-1548 [Journal]
   
4. Marek Freindorf, Yihan Shao, Thomas R. Furlani, Jing Kong
   Lennard-Jones parameters for the combined QM/MM method using the B3LYP/6-31G*/AMBER potential. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2005, v:26, n:12, pp:1270-1278 [Journal]
   
5. 
   Large-Scale QM/MM Calculations of Electronic Excitations in Yellow Protein: Toward Petascale Level of Protein Calculations. [Citation Graph (, )][DBLP]
   
   
6. 
   Towards Thermal Aware Workload Scheduling in a Data Center. [Citation Graph (, )][DBLP]
   
   
7. 
   Thermal aware workload scheduling with backfilling for green data centers. [Citation Graph (, )][DBLP]