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User Information Home
 NCSA's Help Desk is available 24 hours a day, seven days a week, 365 days a year: Computation Chemistry at NCSACHARMm
Brief Description:CHARMM (Harvard version) is a general purpose molecular mechanics, molecular dynamics and vibrational analysis packages for modelling and simulation of the structure and behavior of molecular systems from an individual organic molecule to a large oligomeric protein in its solvent environment. To access CHARMM at NCSA, you have to obtain an authorization letter from Prof. Martin Karplus at Harvard University. The current version that is supported at NCSA is CHARMM 29b2 and available on the IBM p690 (copper), the IBM xSeries 330 (platinum), and the Xeon Cluster (tungsten). For accessing CHARMM at NCSA, please contact Dodi Heryadi.
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