BibTeX records: Michel Dupuis

• > Home > Michel Dupuis

@article{DBLP:journals/jcc/DupuisN19,
  author    = {Michel Dupuis and
               Meghana Nallapu},
  title     = {Maximal orbital analysis of molecular wavefunctions},
  journal   = {J. Comput. Chem.},
  volume    = {40},
  number    = {1},
  pages     = {39--50},
  year      = {2019},
  url       = {https://doi.org/10.1002/jcc.25385},
  doi       = {10.1002/jcc.25385},
  timestamp = {Sat, 30 May 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/journals/jcc/DupuisN19.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcc/MatsubaraDA08,
  author    = {Toshiaki Matsubara and
               Michel Dupuis and
               Misako Aida},
  title     = {An insight into the environmental effects of the pocket of the active
               site of the enzyme. \emph{Ab initio} ONIOM-molecular dynamics {(MD)}
               study on cytosine deaminase},
  journal   = {J. Comput. Chem.},
  volume    = {29},
  number    = {3},
  pages     = {458--465},
  year      = {2008},
  url       = {https://doi.org/10.1002/jcc.20805},
  doi       = {10.1002/jcc.20805},
  timestamp = {Wed, 01 Apr 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/journals/jcc/MatsubaraDA08.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@inproceedings{DBLP:conf/biocomp/DoualiEMD06,
  author    = {Latifa Douali and
               Matt Ernst and
               John Miller and
               Michel Dupuis},
  editor    = {Hamid R. Arabnia and
               Homayoun Valafar},
  title     = {Melting Free Energies of {DNA} Duplexes with oxidized Base Residues
               and Abasic sites: {A} Molecular Dynamics Characterization},
  booktitle = {Proceedings of the 2006 International Conference on Bioinformatics
               {\&} Computational Biology, BIOCOMP'06, Las Vegas, Nevada, USA,
               June 26-29, 2006},
  pages     = {329--337},
  publisher = {{CSREA} Press},
  year      = {2006},
  timestamp = {Mon, 27 Nov 2006 11:07:54 +0100},
  biburl    = {https://dblp.org/rec/conf/biocomp/DoualiEMD06.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@inproceedings{DBLP:conf/iccS/WindusBDHPSSA03,
  author    = {Theresa L. Windus and
               Eric J. Bylaska and
               Michel Dupuis and
               So Hirata and
               Lisa Pollack and
               Dayle M. Smith and
               Tjerk P. Straatsma and
               Edoardo Apr{\`{a}}},
  editor    = {Peter M. A. Sloot and
               David Abramson and
               Alexander V. Bogdanov and
               Jack J. Dongarra and
               Albert Y. Zomaya and
               Yuri E. Gorbachev},
  title     = {NWChem: New Functionality},
  booktitle = {Computational Science - {ICCS} 2003, International Conference, Melbourne,
               Australia and St. Petersburg, Russia, June 2-4, 2003. Proceedings,
               Part {IV}},
  series    = {Lecture Notes in Computer Science},
  volume    = {2660},
  pages     = {168--180},
  publisher = {Springer},
  year      = {2003},
  url       = {https://doi.org/10.1007/3-540-44864-0\_18},
  doi       = {10.1007/3-540-44864-0\_18},
  timestamp = {Mon, 15 Jun 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/conf/iccS/WindusBDHPSSA03.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@inproceedings{DBLP:conf/lssc/AidaYD99,
  author    = {Misako Aida and
               H. Yamataka and
               Michel Dupuis},
  editor    = {Michael Griebel and
               Svetozar Margenov and
               Plamen Y. Yalamov},
  title     = {Modeling of Reactivities of Organic Molecules by Means of Ab Initio
               {MD} Method},
  booktitle = {Large-Scale Scientific Computation for Engineering and Environmental
               Problems, {II} (LSSC'99), Sozopol, Bulgaria, June 2-6, 1999},
  series    = {Notes on Numerical Fluid Mechanics},
  volume    = {73},
  pages     = {319--327},
  publisher = {Vieweg},
  year      = {1999},
  timestamp = {Tue, 26 Feb 2008 00:00:00 +0100},
  biburl    = {https://dblp.org/rec/conf/lssc/AidaYD99.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcc/MarquezOSD97,
  author    = {Antonio M. M{\'{a}}rquez and
               Jaime Oviedo and
               Javier Fern{\'{a}}ndez Sanz and
               Michel Dupuis},
  title     = {Parallel computation of second derivatives of {RHF} energy on distributed
               memory computers},
  journal   = {J. Comput. Chem.},
  volume    = {18},
  number    = {2},
  pages     = {159--168},
  year      = {1997},
  url       = {https://doi.org/10.1002/(SICI)1096-987X(19970130)18:2\&\#60;159::AID-JCC2\&\#62;3.0.CO;2-U},
  doi       = {10.1002/(SICI)1096-987X(19970130)18:2\&\#60;159::AID-JCC2\&\#62;3.0.CO;2-U},
  timestamp = {Wed, 01 Apr 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/journals/jcc/MarquezOSD97.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcc/MarquezD95,
  author    = {Antonio M. M{\'{a}}rquez and
               Michel Dupuis},
  title     = {Parallel Computation of the {MP2} Energy on Distributed Memory Computers},
  journal   = {J. Comput. Chem.},
  volume    = {16},
  number    = {4},
  pages     = {395--404},
  year      = {1995},
  url       = {https://doi.org/10.1002/jcc.540160402},
  doi       = {10.1002/jcc.540160402},
  timestamp = {Wed, 01 Apr 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/journals/jcc/MarquezD95.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}

@article{DBLP:journals/jcc/SchmidtBBEGJKMN93,
  author    = {Michael W. Schmidt and
               Kim K. Baldridge and
               Jerry A. Boatz and
               Steven T. Elbert and
               Mark S. Gordon and
               Jan H. Jensen and
               Shiro Koseki and
               Nikita Matsunaga and
               Kiet A. Nguyen and
               Shujun Su and
               Theresa L. Windus and
               Michel Dupuis and
               John A. Montgomery Jr.},
  title     = {General atomic and molecular electronic structure system},
  journal   = {J. Comput. Chem.},
  volume    = {14},
  number    = {11},
  pages     = {1347--1363},
  year      = {1993},
  url       = {https://doi.org/10.1002/jcc.540141112},
  doi       = {10.1002/jcc.540141112},
  timestamp = {Wed, 01 Apr 2020 01:00:00 +0200},
  biburl    = {https://dblp.org/rec/journals/jcc/SchmidtBBEGJKMN93.bib},
  bibsource = {dblp computer science bibliography, https://dblp.org}
}