[gmx-users] ACPYPE now works with GAFF2

[Anders Støttrup Larsen]

Hi


Cool, is there any article or citation for GAFF2?

Best wishes


Anders

On Tue, Jan 17, 2017 at 7:44 PM, Alan <alanwilter at gmail.com> wrote:

> Now one can do:
>
> acpype -a gaff2 -i ...
>
> See 'acpype -h' for more details:
>
>   -a ATOM_TYPE, --atom_type=ATOM_TYPE
>                         atom type, can be gaff, gaff2, amber (AMBER14SB) or
>                         amber2 (AMBER14SB + GAFF2), default is gaff
>
> Thanks for using ACPYPE,
>
> Alan
>
> --
> Alan Wilter SOUSA da SILVA, DSc
> Senior Bioinformatician, UniProt
> European Bioinformatics Institute (EMBL-EBI)
> European Molecular Biology Laboratory
> Wellcome Trust Genome Campus
> Hinxton
> Cambridge CB10 1SD
> United Kingdom
> Tel: +44 (0)1223 494588
> --
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