namd on frank/markov?

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kravchen
kravchen's picture

Hellol! I'd like to set up NAMD simulations on SAM. Is NAMD installed on frank? It is not listed in the Installed Application section. If yes, is there an example job script (such as for Gaussian/Gamess/etc.)?

I can see namd listed here: http://core.sam.pitt.edu/node/57

Do I need an account on markov to run namd and if yes, how do I create it? (or who should I contact for that?)

Thanks in advance!