[gmx-users] doubt in minimization

gurpreet singh gps.iitm at gmail.com
Mon Jul 23 14:52:22 CEST 2007


Hello users

I am carrying a protein simulation using gromacs 3.3 and g43a1 force field.

My doubt is that when i carried out minimization   i found that that in the
log file there were no energy terms corresponding to some steps, althouigh
minimization went fine without any problem .

What could be the reason for this ?
can i beleive the data obtained from that minimization ?


Thanks

With regards
Gurpreet
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