Noob here (and no C++ expert, either), RDKit looks very promising. I just downloaded it and have tried various (deeply flawed, no doubt) ways to get it to start compiling.
Since the project seems to be VC++ - oriented, can anyone point me to specific docs for compiling RDKit on Linux? I've had a look at Docs/SoftwareRequirements.txt, which nicely lists all of the ingredients - I'm wondering about the build recipe itself. thanks, Rich ___________________________________ Richard L. Apodaca http://depth-first.com Blog http://metamolecular.com Company