Open mjw99 opened 2 years ago
I've managed to add in the official validation suite provided by the MMFF94{s} authors via the SI files in https://doi.org/10.1186/s13321-014-0037-3 as JUnit tests. These can be found here and CI here.
Would there be interest in pulling this to the master?
I've managed to add in the official validation suite provided by the MMFF94{s} authors via the SI files in https://doi.org/10.1186/s13321-014-0037-3 as JUnit tests. These can be found here and CI here.
Would there be interest in pulling this to the master?