Re: [gmx-users] POL3 water model

Dear Saly from my little experience, POL3 water model is a point polarizable water model. Point polarizable water models are not available in gromacs. Gromacs uses shell model, i.e. charge attached on a spring to mimic the stretching of the electronic cloud. So you have 3 solutions a) Yo

[gmx-users] POL3 water model

Hi all I want to simulate using GROMACS.Before I used LAMMPS but it has not polarizable water models. Therefore I want to use GROMACS. I need .itp and .mdp files of POL3 water model. Do you have the files. Would you please help me. Thanks alot for your time and attention Regards Saly -- gm