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Publications of Author

1. Yuri Alexeev, Michael W. Schmidt, Theresa L. Windus, Mark S. Gordon, Ricky A. Kendall
   Performance and Implementation of Distributed Data CPHF and SCF Algorithms. [Citation Graph (0, 0)][DBLP]
   CLUSTER, 2002, pp:135-0 [Conf]
   
2. Zhengting Gan, Yuri Alexeev, Ricky A. Kendall, Mark S. Gordon
   A Distributed Data Implementation of Parallel Full CI Program. [Citation Graph (0, 0)][DBLP]
   CLUSTER, 2002, pp:476-479 [Conf]
   
3. Jerry Boatz, Mark S. Gordon, Gregory A. Voth, Sharon Hammes-Schiffer, Ruth Pachter
   New Materials Design. [Citation Graph (0, 0)][DBLP]
   International Conference on Computational Science (1), 2001, pp:1108-1116 [Conf]
   
4. Mark S. Gordon, Michael W. Schmidt
   Recent Advances in QM and QM/MM Methods. [Citation Graph (0, 0)][DBLP]
   International Conference on Computational Science, 2003, pp:75-83 [Conf]
   
5. Nurzhan Ustemirov, Masha Sosonkina, Mark S. Gordon, Michael W. Schmidt
   Dynamic Algorithm Selection in Parallel GAMESS Calculations. [Citation Graph (0, 0)][DBLP]
   ICPP Workshops, 2006, pp:489-496 [Conf]
   
6. Ryan M. Olson, Michael W. Schmidt, Mark S. Gordon, Alistair P. Rendell
   Enabling the Efficient Use of SMP Clusters: The GAMESS/DDI Model. [Citation Graph (0, 0)][DBLP]
   SC, 2003, pp:41- [Conf]
   
7. Cheol Ho Choi, Klaus Ruedenberg, Mark S. Gordon
   New parallel optimal-parameter fast multipole method (OPFMM). [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2001, v:22, n:13, pp:1484-1501 [Journal]
   
8. Dmitri G. Fedorov, Ryan M. Olson, Kazuo Kitaura, Mark S. Gordon, Shiro Koseki
   A new hierarchical parallelization scheme: Generalized distributed data interface (GDDI), and an application to the fragment molecular orbital method (FMO). [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 2004, v:25, n:6, pp:872-880 [Journal]
   
9. Takako Kudo, Fujiko Hashimoto, Mark S. Gordon
   Ab initio study of cyclic siloxanes (H2SiO)n: n = 3, 4, 5. [Citation Graph (0, 0)][DBLP]
   Journal of Computational Chemistry, 1996, v:17, n:9, pp:1163-1170 [Journal]
   
10. Timothy J. Dudley, Ryan M. Olson, Michael W. Schmidt, Mark S. Gordon
    Parallel coupled perturbed CASSCF equations and analytic CASSCF second derivatives. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:3, pp:352-362 [Journal]
    
11. Dmitri G. Fedorov, Kazuo Kitaura, Hui Li, Jan H. Jensen, Mark S. Gordon
    The polarizable continuum model (PCM) interfaced with the fragment molecular orbital method (FMO). [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 2006, v:27, n:8, pp:976-985 [Journal]
    
12. Meng-Shiou Wu, Jonathan L. Bentz, Fang Peng, Masha Sosonkina, Mark S. Gordon, Ricky A. Kendall
    Integrating Performance Tools with Large-Scale Scientific Software. [Citation Graph (0, 0)][DBLP]
    IPDPS, 2007, pp:1-8 [Conf]
    
13. 
    Adaptive Application Composition in Quantum Chemistry. [Citation Graph (, )][DBLP]
    
    
14. 
    Constructing a performance database for large-scale quantum chemistry packages. [Citation Graph (, )][DBLP]
    
    
15. 
    Development of high performance scientific components for interoperability of computing packages. [Citation Graph (, )][DBLP]