Hi, I would like to know if anybody has reproduced the physical properties of dioxane (like dielectric constant, dipole moment, etc) in GROMACS. If so, what force field was found to be optimum?
If not, then anybody has any idea about which force field to start with? Thanking you, banskt -- ------------------------------------------------------------------- Saikat Banerjee Integrated Ph.D student Solid State and Structural Chemistry Unit (SSCU) Indian Institute of Science Bangalore-560012 -------------------------------------------------------------------
-- gmx-users mailing list gmx-users@gromacs.org http://lists.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 gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/mailing_lists/users.php
