[gmx-users] Neutralize or add an Ions Concentration for a Membrane Simulation?
og_andres15 at hotmail.com
Sat Mar 8 05:15:14 CET 2014
Hi Dear Gromacs Users, i would like to ask you something,
My system consist of an ion channel , and a drug molecule, i´m preparing a
to study the PME between the protein and the molecule, so , i´ve been
reading papers, and some of them
just add ions to neutralize the system, but other just use a concentration
of KCL ,
What do you think is the best option for me(considering my system), and how
is the effect to add a concentration of ions, is it cause more computation ?
thanks in advance
View this message in context: http://gromacs.5086.x6.nabble.com/Neutralize-or-add-an-Ions-Concentration-for-a-Membrane-Simulation-tp5015028.html
Sent from the GROMACS Users Forum mailing list archive at Nabble.com.
More information about the gromacs.org_gmx-users