ChemAxon 60ee1f1328
23-10-2007 14:18:11
Hello again,
This time I seem to have the following problem:
Some of the molecules in my input set "NaKLiCovalentO.sdf" do not map as expected to output set "NaKLiCovalentO_out.sdf" according to SMARTS defined in "LiNaKCovalentO.sma" In particular the P-O-L and S-O-L do not appear to work correctly - is there somting wrong with the SMARTS I defined?
JCHEM 3.2.6 currently...
Cheers,
Daniel.
This time I seem to have the following problem:
Some of the molecules in my input set "NaKLiCovalentO.sdf" do not map as expected to output set "NaKLiCovalentO_out.sdf" according to SMARTS defined in "LiNaKCovalentO.sma" In particular the P-O-L and S-O-L do not appear to work correctly - is there somting wrong with the SMARTS I defined?
JCHEM 3.2.6 currently...
Cheers,
Daniel.