Hello all, My system is polyacrylamide in water. I need to coarse-grain the system traversing through a concentration range. What I plan to do is IBI using the MARTINI water model since this water model gives a viscosity value close to that of SPC-E (water model in my atomistic system) and viscosity is the major property of interest in my case. IBI would then be carried out to optimize the potentials between the polymers and polymer-water, whereas the water-water interaction would be directly taken up from MARTINI. Since MARTINI uses a 4:1 mapping, I was wondering whether this idea would be viable if I am to use votca.
Thanks in advance! -Pallavi Banerjee -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To post to this group, send email to [email protected]. Visit this group at http://groups.google.com/group/votca. For more options, visit https://groups.google.com/d/optout.
