Dear all,
I am trying to corvariance matrix by ptraj.
The action "rms" is fine.
But when I used "matrix", there is no output at all.
Any suggestion is welcome.
Here is my input:
reference native.prmcrd
trajin all.dcd
rms reference mass :2-117.CA,C,N
center :2-117 mass origin
image origin center
matrix covar .CA out distmat.dat
have a nice weekend.
Best,
Sichun
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Received on Sat Apr 24 2004 - 02:53:00 PDT
