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denoptim-project / DENOPTIM

DENOPTIM is a software package for de novo design and virtual screening of functional molecules of any kind.
GNU Affero General Public License v3.0
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Running tests on W10 #89

Closed agiani99 closed 2 years ago

agiani99 commented 2 years ago

HI everyone running suggested runAllTests.sh from git Bash shell does not complete. Can you test it? Is it something that has to do with specific bash requirements or runAllTests.sh has been created only for Mac/Linux? Best andrea

marco-foscato commented 2 years ago

Hi Andrea, yes, the script was born on Unix systems and several tests can be run only on Mac/Linux computers. This is due entirely to the fact that the checks performed on the results of denoptim's calculations are done using Bash functionality that is not available on GitBash. Moreover, it is meant to test a local built of denoptim, not the installation obtained from conda. So, after building denoptim with maven on GitBash, the runAllTests.sh script should run only those tests that can be run there (namely: t2b, t2c, t12a, t12c, t14-t26, t28, t29). I just tried, and it took around 4 min to complete. Still, it is entirely possible that there is some GitBash tweak going wrong on your system. Could you be more specific as to where and how it fails to complete?

Best regards, Marco

marco-foscato commented 2 years ago

closing the issue according to email from Andrea.