Gaff.dat is missing in currently pre-released Avogadro 1.2.
I think this causes incorrect Gaff energy by extensions/molecular
mechanics/calculate energy menu.
I hope AvoCPack.cmake could include gaff.dat.
Thank you for having you instruct a version of msvc.
2016-06-14 3:55 GMT+09:00 Patrick Avery <psav...@buffalo.edu>:
> Looks like that one was left out here:
>
>
> https://github.com/cryos/avogadro/blob/master/cmake/modules/AvoCPack.cmake#L60
>
> It's currently only including *.txt, *.par, *.prm, and *.ff
>
> I can add *.dat and recompile. Let me know if there are any others that
> are missing.
>
> On Mon, Jun 13, 2016 at 2:33 PM, Geoffrey Hutchison <
> geoff.hutchi...@gmail.com> wrote:
>
>> Please make sure to CC the list. Are you saying that gaff.dat is not in
>> the install directory? (I don't know - I don't use Windows.) The binary was
>> provided by Patrick Avery.
>>
>> I believe VS 2010 was used for this build.
>>
>> -Geoff
>>
>> > On Jun 11, 2016, at 4:57 AM, iwao aoyama <iwao.aoy...@gmail.com> wrote:
>> >
>> > Why does not Avogadro-1.2.0-win32.exe put gaff.dat in the (install
>> directory)/bin directory?
>> >
>> > I wonder what version of Visual Studio compiled Avogadro 1.2.
>> >
>> > -Aoyama Iwao
>>
>>
>>
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