James C. Phillips Rosemary Braun Wei Wang James Gumbart Emad Tajkhorshid Elizabeth Villa Christophe Chipot Robert D. Skeel Laxmikant V. Kalé Klaus Schulten Scalable molecular dynamics with NAMD. 1781-1802 2005 26 Journal of Computational Chemistry 16 http://dx.doi.org/10.1002/jcc.20289 db/journals/jcc/jcc26.html#PhillipsBWGTVCSKS05