VMD-L Mailing List

From: Jonasz Sowada (j.sowada_at_icloud.com)
Date: Sat Dec 31 2016 - 17:34:33 CST

Dear VMD users,

I'm using VMD as visualization&postprocessing tool for trajectory obtained from CPMD, and my system is bipirydine with aceton molecules as solvent, but unfortunately VMD doesn't recognize aceton molecules as solvent (in second case i.e. bipirydine + MetOH VMD correctly recognise MetOH molecules as solvent, so I don't know why) and I'd like to calculate radial pair distribution function, do you have any suggests how to fix this or maybe some workaround?

Happy New Year!

Regards,
JS