[gmx-users] PCA

Tuba Kilinc tkilinc at gmail.com
Wed Oct 31 21:04:53 CET 2012


hi

i ve simulated 10 peptides in a cubic box and i ve trajectory files for
several times for example from 5 ns to 200 ns. i want to perform PCA on my
resulting trajectories.but i dont know how i extract a trajectory for each
peptide.

thanks for now



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