[gmx-users] Library file ffamber_tip3p.gro not found in current directory

sunita gupta sunita.bio at gmail.com
Wed Feb 23 09:26:49 CET 2011


Hello Everyone

I am setting up a system for protein ligand complex using amber force filed
with Gromacs 4.5.
in pdb2gmx command i used -water tip3p
but when executing genbox command with -cs ffamber_tip3p.gro....I am getting
follwing error "*Fatal error:
Library file in current dir nor  not found ffamber_tip3p.groin default
directories.
(You can set the directories to search with the GMXLIB path variable)*

Also I manually edited the complex.top file tip3p.itp ->
ffamber_tip3p.itp...still the problem persists
I searched the /gromacs-4.5/share/gromacs/top directory, and did not find
any such file there...
Can anyone please guide me where I can get ffamber_tip3p.gro file or solve
my problem?


-- 
-- 
SUNITA GUPTA
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