Hello Gromacs Users, "gmx sasa" in Gromacs 5.0.6 returns a message stating that all atom radii are obtained from the following reference:
"A. Bondi, van der Waals Volumes and Radii, J. Phys. Chem. 68 (1964) pp. 441-451" Can the user still control the radii used by editing a local copy of the share/gromacs/topvdwradii.dat file? Best, Eric -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
