Hi Peng, In addition to the Daylight documentation on SMILES, there is also OpenSMILES, which OpenBabel supports:
http://opensmiles.org/ And IUPAC is in the early stages of building on OpenSMILES, with IUPAC SMILES+: https://github.com/IUPAC/IUPAC_SMILES_plus Vin -----Original Message----- From: Peng Yu <[email protected]> Sent: Tuesday, November 5, 2019 1:19 PM To: [email protected] Subject: [Open Babel] Official reference of SMILES Hi, I am wondering where is the official reference of SMILES. Is this one? Thanks. https://www.daylight.com/dayhtml/doc/theory/theory.smiles.html -- Regards, Peng _______________________________________________ OpenBabel-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/openbabel-discuss _______________________________________________ OpenBabel-discuss mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
