Hello Folks, Is there any difference between these two anisotropic pressure setup?
### 1st setup ### pcoupl = berendsen pcoupltype = anisotropic tau_p = 5.0 5.0 5.0 0.0 0.0 0.0 compressibility = 4.53e-5 4.53e-5 4.53e-5 0.0 0.0 0.0 ref_p = 1.025 1.025 1.025 0.0 0.0 0.0 ### 2nd setup ### pcoupl = berendsen pcoupltype = anisotropic tau_p = 5.0 5.0 5.0 5.0 5.0 5.0 compressibility = 4.53e-5 4.53e-5 4.53e-5 0.0 0.0 0.0 ref_p = 1.025 1.025 1.025 1.025 1.025 1.025 Which one would you suggest for anisotropic coupling (solvated pore immersed into a membrane) Thanks, MG. _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
