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Web-Based Computational Chemistry Education with CHARMMing I: Lessons and Tutorial

  • Benjamin T. Miller ,

    btmiller@nhlbi.nih.gov (BTM); hlw@usf.edu (HLW)

    Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, Bethesda, Maryland, United States of America

  • Rishi P. Singh,

    Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, Bethesda, Maryland, United States of America

  • Vinushka Schalk,

    Affiliation Department of Natural Sciences, New College of Florida, Sarasota, Florida, United States of America

  • Yuri Pevzner,

    Affiliation Department of Chemistry, University of South Florida, Tampa, Florida, United States of America

  • Jingjun Sun,

    Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, Bethesda, Maryland, United States of America

  • Carrie S. Miller,

    Current address: Department of Biology and Chemistry, Azusa Pacific University, Azusa, California, United States of America

    Affiliation Department of Chemistry, Georgetown University, Washington, D.C., United States of America

  • Stefan Boresch,

    Affiliation Department of Computational Biological Chemistry, Faculty of Chemistry, University of Vienna, Vienna, Austria

  • Toshiko Ichiye,

    Affiliation Department of Chemistry, Georgetown University, Washington, D.C., United States of America

  • Bernard R. Brooks,

    Affiliation Laboratory of Computational Biology, National Heart, Lung, and Blood Institute, Bethesda, Maryland, United States of America

  • H. Lee Woodcock III

    btmiller@nhlbi.nih.gov (BTM); hlw@usf.edu (HLW)

    Affiliation Department of Chemistry, University of South Florida, Tampa, Florida, United States of America

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