Hi, We are planning a cheminformatics web application with a database back-end and we like to use CDK as far as possible. I read that the SmilesParser ignores chirality and other stereo information, but we think we need it for descriptor calculation and predictions of pharmacokinetic properties. Are there any plans to implement this in near future? If not, we have to decide if we should store MOL-files or another representation in the DB along with the cannonical SMILES. Any suggestions? Or maybe you guys now another library which can convert chiral SMILES in CDK's AtomContainer and perseves the stereochemical informations?
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