Hi all and especially Szilard! My glorious management asked me to post this here. One of our group members, an ex-NAMD guy, wants to use Gromacs for biophysics and the following basics have been spec'ed for him:
CPU: Xeon Gold 6244 GPU: RTX 5000 or 6000 I'll be surprised if he runs systems with more than 50K particles. Could you please comment on whether this is a cost-efficient and reasonably powerful setup? Your past suggestions have been invaluable for us. Thank you, Alex -- 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.