[gmx-users] TFE-water simulation

[Archana Sonawani-Jagtap]

Hi all,

I have never performed TFE-water simulation therfore I want to know after
inserting the peptide in the pre-equilibrated TFE-water mixture, do we need
to adjust the number of TFE or water molecules ?

or should I directly add ions to this system and run the production run.

Any suggestion is welcome.

Thank you.
-- 
Archana Sonawani-Jagtap
Senior Research Fellow,
Biomedical Informatics Centre,
NIRRH (ICMR), Parel
Mumbai, India.
9960791339