Drop ChemmineOB
as dependency and call OpenBabel more directly
#106
Labels
ChemmineOB
as dependency and call OpenBabel more directly
#106
If I remember correctly, we only use
ChemmineOB
(viaChemmineR
) in a few places:It may be possible to write our own functions that use the Open Babel C++ library rather than requiring
ChemmineOB
. This would give greater control over installation and build issues, but would require more knowledge of including C++ code in R packages than I currently have.The text was updated successfully, but these errors were encountered: