At 2011-03-14 20:44:42£¬gromacs <ptf1242.163.com> wrote:
Hi everyone,
I use AMBER 9.
Can anybody tell me how to get 4x4x1.1 box, and then fill this box with water (e.g. SPCBOX)?
i know SolvateOct will solvate a cubic water box.
I can use command: a=copy SPC
then use: solvateOct or solvateBox a SPCBOX 9
but i do not know how to obtain a rectangle with water, and also need the density is around 1 g/cc.
Thanks in advance!
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Received on Wed Apr 06 2011 - 21:30:02 PDT
