Dear All,
I have a small question that needs convince.
I calculate the NMR structure using dg_sub_embed.inp, dgsa.inp, refine.inp and
accept.inp consecutively.
In the refine.inp file, the line of "Filename(s) for embedded coordinates."
(see below), I should fill in the structure calculated from dgsa.inp as the
$filename, rather than those from dg_sub_embed.inp, right?
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{====>}
evaluate ($end_count=50) {*Loop through a family of 10 structures.*}
evaluate ($count = 0)
while ($count < $end_count ) loop main
evaluate ($count=$count+1)
{====>} {*Filename(s) for embedded coordinates.*}
evaluate ($filename="dgsa_"+encode($count)+".pdb")
coor @@$filename
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Thanks for any confirmation.
Victor