We are processing (mainly Marco Fanton at Univ. of Padova) lot of public sources for the next MMsINC release; please feel free to contact me if you have any SDF catalog, it will be our pleasuse to process and incorporate it (with the appropriate link to your Company or Institute).
Thursday, 19 August 2010
I have implemented the Ultrafast Shape Recognition method (Ballester and Richards, Proc. R. Soc. A., 2007) for the next MMsINC release... pure Python implementation, no external libraries required, fast calculation. I'm looking for a small dataset for the validation of my script. If you are interested in the source code, please send me an email at email@example.com.