zzhwise1 wrote:
hello ,everyone
I have two problems:
(1)my model is compost of 36 long chain of CH3(CH2)14COOH ,and use the
frocefiled of ffgmx,
but the mdrun can only going to the 2th step,and the some chains change
large
(2)can this program do the nanotribology of monolayer?
thanks advanced!
wait for your answer!
check your starting structure. start with one molecule, minimize, do MD
and then go to 36 molecules.
your friend
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David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
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