Dear Madam/Sir,


I was wondering if it is possible to run the Surfnet calculation using the command line tool. I wish to automate it for MD trajectory for every frame and this would be useful.


Thank you!


Samo


Dr. Samo Lešnik, mag. farm. / Researcher
Univerza v Mariboru / University of Maribor
Fakulteta za kemijo in kemijsko tehnolgijo
Faculty of Chemistry and Chemical Engineering
Smetanova ulica 17, 2000 Maribor, Slovenija
T: +386 2 2294 428