[gmx-users] PCA projections using g_anaeig
jmsstarlight at gmail.com
Wed Jan 28 15:24:09 CET 2015
Dear Gromacs users!
I'd like to ask about possibility to make projection of the MD trajectory
onto the subset of selected PC calculated by g-covar
g_anaeig –v eigenvec.trr –s md.tpr –f md.xtc –first 1 –last 3 -2d
produce projection of the md.xtc onto the 1 and 2 components although 1-3
modes has been calculated. How it would be possible to make the same graph
using 1 and 3rd components instead?
Thanks for help,
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