On 1/12/2010 3:20 PM, Yang Ye wrote:
Please use "find" to locate FF.dat in your particular installation.
That mechanism is deprecated in GROMACS 4.5, like the OP said :-)
Mark
Regards,
Yang Ye
On Wed, Dec 1, 2010 at 12:17 PM, Jia Haitao <[email protected]
<mailto:[email protected]>> wrote:
Dear all,
I have constructed a new CG force field named "polycg", and
added them to direction ..$GMXLIB/polycg.ff. Can anybody tell me
how to add my new force field to gromacs default force field list,
in case I can use it to convert pdb files in program pdb2gmx.
My gromacs version is 4.5. There is not FF.dat file in
direction $GMXLIB any more.
I will be very appreciate for your help.
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