[gmx-users] Water model => amber port to gromacs

Mark Abraham Mark.Abraham at anu.edu.au
Fri Nov 7 09:05:09 CET 2008


Chih-Ying Lin wrote:
> Hi
> Water model => amber port to gromacs
> 
> The two steps are shown on the archive.
> 1. #include ffamber_tip*p    in the .top file
> 2. include an #ifdef_FF_AMBER statement in tip*p.itp

If you want others' opinions for free, please provide links - and test 
them first to see that you've linked to the content, and not some 
wrapper page/frame! :-)

> Should I also #include ffamber99.tip in the .top file?

"tip" does not equal "itp" :-)

Mark



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