On 08/29/2018 01:54 PM, Chris Murphy wrote: > Hi, > > I finally realized that when passing an sdf string to Chem.MolFromMolBlock, > the Mol object will not retain the properties from the sdf.
Ugh. You're right. +1 for a MolFromSdfBlock() that doesn't lose the properties. > Also, it seems that SDMolSupplier.next() does not work anymore? if sys.version_info[0] == 2 : next() elif sys.version_info[0] == 3 : __next()__ else : raise Exception( "Go! is looking better every day" ) -- Dimitri Maziuk Programmer/sysadmin BioMagResBank, UW-Madison -- http://www.bmrb.wisc.edu
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