Hi, Please forgive me for this slightly off-topic question. Suppose I use the particle mesh Ewald algorithm for the computation of electrostatic interactions. It is often mentioned in the literature that the PME algorithm scales as O(N logN), and that the electrostatic interactions are the most computationally expensive part of MD. Is it thus reasonable to say that MD overall scales as O(N logN)? Or does MD overall scale in some other way? I have been having difficulty finding a textbook or paper that states or estimates the scaling of MD.
Thank you so much for your time! Andrew DeYoung Carnegie Mellon University -- 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/Support/Mailing_Lists/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/Support/Mailing_Lists
