install Gromacs in Travis CI

Becksteinlab / GromacsWrapper

GromacsWrapper wraps system calls to GROMACS tools into thin Python classes (GROMACS 4.6.5 - 2024 supported).

https://gromacswrapper.readthedocs.org

GNU General Public License v3.0

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install Gromacs in Travis CI #79

Closed orbeckst closed 8 years ago

orbeckst commented 8 years ago

Install

[ ] Gromacs 5.1.x
[ ] Gromacs 4.6.7 so that we can run a build matrix.

Needed to complete #39.

See Also: PR Becksteinlab/MDPOW#44 and issue Becksteinlab/MDPOW#41.

orbeckst commented 8 years ago

@ianmkenney please apply your magic from Becksteinlab/MDPOW#44 !

orbeckst commented 8 years ago

Once PR #69 is merged, we won't need a fancy cfg file anymore because tools will be autoloaded.

ianmkenney commented 8 years ago

Will do!

On 08/02/2016 05:03 PM, Oliver Beckstein wrote:

@ianmkenney https://github.com/ianmkenney please apply your magic from Becksteinlab/MDPOW#44 https://github.com/Becksteinlab/MDPOW/pull/44 !

— You are receiving this because you were mentioned. Reply to this email directly, view it on GitHub https://github.com/Becksteinlab/GromacsWrapper/issues/79#issuecomment-237088709, or mute the thread https://github.com/notifications/unsubscribe-auth/AGwcbN0ahUfNOh88dX72XjebesAuUQMDks5qb9rcgaJpZM4JbK95.

pslacerda commented 8 years ago

With tests in place we can go wild guaranteeing that it still works.

orbeckst commented 8 years ago

On 2 Aug, 2016, at 18:57, Pedro Lacerda notifications@github.com wrote:

With tests in place we can go wild guaranteeing that it still works.

Yes, that's the idea. But first we need to clean up the existing tests and add a few new ones.

Oliver Beckstein * orbeckst@gmx.net skype: orbeckst * orbeckst@gmail.com