Hi,
I constructed some (about 200 atoms) molecule, have got itp and gro files for
it using PRODRG
server and put it in water box.
Short test run was O'K. But when I tried long run I have got message:
after about 1.5ns time:
Change name Cl to name CL and check name Na in forcefield you use (it could be
NA).
11 декабря 2011, 17:30 от Mark Abraham mark.abra...@anu.edu.au:
On 11/12/2011 11:43 PM, yp sun wrote:
The name of ion is different when using different force field You can check
which field
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