Dear Amber users;
anybody please tell use of nmropt . I am doing annealing. I did
annealing with both nmropt = 1 and nmropt = 0... and what is
requirement to use nmropt option..(as much I know,may be wrong also, it
helps in temp0 recognition )
hope following information will suffice this discussion:
for nmropt = 1, when I plotted Radius of gyration(Rg), the graph shows
smooth ups and downs in curve i.e. Rg is varying, as expected, because
temp is varied in annealing
but for nmropt = 0 Rg donot vary, it decreases
initialy and remain same after that.. no ups and down in curve as
it should be..
thanks and regards,
JIomm
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Received on Mon Sep 14 2009 - 11:51:40 PDT
