Dear users:
I want to analyse a crystal structure by PCA, and want to show its 2D
projection, but I meet errors" segment fault"
my procedure:
g_covar_d -f crystal strucutre.pdb -s crystal strucutre.pdb -o eig.xvg -v
eig.trr
g_anaeig_d -f crystal strucutre.pdb -eig eig.xvg -v eig.trr -2d 2d.xvg -first
1 -last 2
but produce errors.
Please help me!
thank you!
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