New release?

[acmnpv]

Hej @ all!

Just a food for thought, should we release a new version of Q6 with the few bug fixes we had around May or June this year? Should just be a bump to the minor version number, to make sure the bug fixes are used by people?

Happy for your feedback!

[mpurg]

Kudos for all the recent activity!

I suggest changing the silly "compilation version" to a patch version as described here: https://semver.org/

2018-02-05 15:42 GMT+01:00 Paul Bauer notifications@github.com:

Hej @ all!

Just a food for thought, should we release a new version of Q6 with the few bug fixes we had around May or June this year? Should just be a bump to the minor version number, to make sure the bug fixes are used by people?

Happy for your feedback!

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[acmnpv]

I'm in support of changing this. Miha, can you supply the patch?

[acmnpv]

Notes from quick meeting with Miha on what to do for the 6.1 release:

• Need to fix #5 to cause an error in qprep
• The fix for #10 should be reviewed and merged if people decide it is needed
• The semantic version scheme Miha proposed should be adopted
• Add ability to set solvent w/o solvating
• Test to see how difficult it will be to add different types of solute to qprep
• Check few more possible bugs discussed with Pierre
• Get minimizer working
• Discuss changing Coulomb constant to the experimental value of 332.06371 kcal/mol Å e^-2

[kamerlin]

Thanks Paul!

From: Paul Bauer notifications@github.com Reply-To: qusers/Q6 reply@reply.github.com Date: Thursday, February 22, 2018 at 10:43 AM To: qusers/Q6 Q6@noreply.github.com Cc: Subscribed subscribed@noreply.github.com Subject: Re: [qusers/Q6] New release? (#13)

Notes from quick meeting with Miha on what to do for the 6.1 release:

• Need to fix #5https://github.com/qusers/Q6/issues/5 to cause an error in qprep
• The fix for #10https://github.com/qusers/Q6/issues/10 should be reviewed and merged if people decide it is needed
• The semantic version scheme Miha proposed should be adopted
• Add ability to set solvent w/o solvating
• Test to see how difficult it will be to add different types of solute to qprep
• Check few more possible bugs discussed with Pierre
• Get minimizer working

— You are receiving this because you are subscribed to this thread. Reply to this email directly, view it on GitHubhttps://github.com/qusers/Q6/issues/13#issuecomment-367623896, or mute the threadhttps://github.com/notifications/unsubscribe-auth/AGRJR21E_g8r82N3DsRwNPY5G_RKZiAdks5tXTa1gaJpZM4R5i0Y.