Dear all,
I would like to use the "parm.frosst" parameters to prepare my ligands in Ambertools.
I know that Moe has the param.Frosst files implemented in its ff database, but as I don't have a Moe license, I need to use Ambertools. Apparently, the needed .frcmod file can be downloaded from
http://www.ccl.net/cca/data/parm_at_Frosst/.
I checked the ambermd archive, where I found an old discussion about using the parameters from
http://www.ccl.net/cca/data/parm_at_Frosst/ (
http://archive.ambermd.org/201202/0316.html),
but apparently these parameters were never implemented in Ambertools?
Does anyone know how to manually implement the param.frosst parameters in Ambertools in order to prepare the ligand with these parameters? I tried various things, but none of them appeared to work out.
Any suggestion would be greatly appreciated!
Anne
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Received on Wed Aug 09 2017 - 07:00:02 PDT