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Dannnno / Chemistry

Simulation of organic chemistry reactions has been moved here
https://github.com/PyCAOS/CAOS
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SMILES strings #18

Closed Dannnno closed 9 years ago

Dannnno commented 9 years ago

I should be able to handle individual SMILES strings (or even lots of them)

Dannnno commented 9 years ago

inCHL files should be supported as well (they're the IUPAC standard apparently)

Dannnno commented 9 years ago

I'm pretty sure I'm gonna pass this off to OpenBabel instead