Re: [AMBER-Developers] antechamber ATCOR.dat incomplete

From: case <>
Date: Tue, 11 Dec 2012 21:02:26 -0500

On Tue, Dec 11, 2012, Eric Pettersen wrote:

> I don't know if I should report problems like this on this list or
> on the main mailing list, so feel free to let me know if this is the
> wrong place, but here goes: with the advent of the new atom types in
> parm10.dat and frcmod.ff99SB, the file for translating standard Amber
> types to GAFF types (ATCOR.dat) is no longer complete. The missing
> types are CO, 2C, 3C, C8, and CX. to Junmei, since I don't know how to make the fix.


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Received on Tue Dec 11 2012 - 18:30:03 PST
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