[gmx-users] mindist during MD
spitaleri.andrea at hsr.it
spitaleri.andrea at hsr.it
Thu Mar 22 00:17:32 CET 2007
Hi all,
my rlist = rcoulomb = rvdw = 0.9 and during my simulation I have mindist
0.968 at 460 ps over 2ns total. the starting point was 1.8 and the
mindist fluctuates from 1 to 2. is it normal this kind of behaviour (so
spread I mean)? the box and the volume seem okay.
any help?
thanks in advance
Regards,
andrea
Andrea Spitaleri PhD
Dulbecco Telethon Institute
c/o DIBIT Scientific Institute
Biomolecular NMR, 1B4
Via Olgettina 58
20132 Milano (Italy)
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