AMBER: TIP4P

From: Nikolai Smolin <smolin.steak.chemie.uni-dortmund.de>
Date: Mon, 16 Feb 2004 11:58:56 +0100

Hallo Amber users!

Have somebody expirience with MD simulation TIP4P in AMBER?

I can not understand how I can prepaed this water model for simulation?
For example it is must be some dummy atoms with charge only.
And I think frcmod file for this model wrong.
solvents.cmd also


Thank in advance
with best regards

Nikolai Smolin 


-- 
Dipl.-Phys. Nikolai Smolin
Physikalische Chemie I
Universitaet Dortmund
Otto-Hahn-Str. 6
44221 Dortmund
Germany
Tel:     +49 / 231 / 755 3929
Fax:     +49 / 231 / 755 3901
E-mail:  smolin.pci.chemie.uni-dortmund.de
E-mail:  nikolai.smolin.uni-dortmund.de
www: http://pci.chemie.uni-dortmund.de/~smolin/
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Received on Mon Feb 16 2004 - 11:53:00 PST
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