[gmx-users] typo in ffoplsaanb.itp for opls_179 (OS) and opls_180 (OS)

Mark Abraham Mark.Abraham at anu.edu.au
Tue Dec 15 06:33:28 CET 2009

Pradip Biswas wrote:
> Hi,
> The atomic numbers of the atom types opls_179 (OS) and opls_180 (OS) are 
> typed in as 7 in ffoplsaanb.itp instead of 8. Accordingly, while doing 
> QMMM, these oxygen atoms are being recognized as Nitrogen atoms. 

DvdS fixed this in the git source earlier this week.


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