[gmx-users] TFE-water simulation
ask.archana at gmail.com
Wed Oct 23 13:20:23 CEST 2013
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.
Senior Research Fellow,
Biomedical Informatics Centre,
NIRRH (ICMR), Parel
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