
31 Aug
2022
31 Aug
'22
12:49 a.m.
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 E: samo.lesnik@um.si<mailto:samo.lesnik@um.si>