OpenBabel is able to read Raman activities from Gaussian output, but, as far as I understood, it stores read activities to the same type of object as used to store IR intensities (OBVibrationData)
It would be useful to have ability to distinct, what type of intensities is stored in that object. In this case program, linked with OB, will be able, for example, to show user what type of spectrum was read -- Regards, Konstantin ------------------------------------------------------------------------------ Come build with us! The BlackBerry(R) Developer Conference in SF, CA is the only developer event you need to attend this year. Jumpstart your developing skills, take BlackBerry mobile applications to market and stay ahead of the curve. Join us from November 9 - 12, 2009. Register now! http://p.sf.net/sfu/devconference _______________________________________________ OpenBabel-Devel mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/openbabel-devel
