AMBER: supplement ptraj:problems with time correlation calculation (comp. with NMR experiments)

From: <anna.schrey.gmx.de>
Date: Sun, 08 Apr 2007 16:15:22 +0200

Dear AMBER community,

I forgot -when I try to calculate a corr vector for :x.CA and :x.HA, ptraj crashes with a segmentation fault. I found the problem also in the mailing archive, but no answer for it. By the way, the calculation of a dipole vector worked for my trajectory, but I guess it is useless for my problem...

Best regards,

Anna 
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Received on Wed Apr 11 2007 - 06:07:07 PDT
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