On Thu, Nov 13, 2008, oguz gurbulak wrote:
>
> How can I load opls force field ( opls_parm.dat, opls_*.in files ) into leap?
You would use the LoadAmberParams and LoadAmberPrep commands. But be very
careful: the files are *not* current OPLS-AA files, but rather united atom
files that are more than two decades old. Don't use these unless you are sure
you know what you are doing. If you need a united atom force field, consider
ff03ua instead.
...dac
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Received on Fri Dec 05 2008 - 14:39:03 PST
