Closed UnixJunkie closed 2 months ago
we should not enforce that the number of molecules and names in files given by -i and --scores match. -i could point a fixed fragments file; --scores points to scored molecules which can be used to update some fragments' distributions
done
UnixJunkie
commented
2 months ago
we should not enforce that the number of molecules and names in files given by -i and --scores match. -i could point a fixed fragments file; --scores points to scored molecules which can be used to update some fragments' distributions