[gmx-users] Classical Ewald summation

2012-04-14 Thread Andrew DeYoung
Hi, I seem to remember reading somewhere that the classical Ewald algorithm is compatible with particle decomposition runs, but I can't seem to find this statement in the manual. Also, when I try running an NVT simulation with either -pd or -dd, I get the following message: The integration or

Re: [gmx-users] Classical Ewald summation

2012-04-14 Thread Justin A. Lemkul
Andrew DeYoung wrote: Hi, I seem to remember reading somewhere that the classical Ewald algorithm is compatible with particle decomposition runs, but I can't seem to find this statement in the manual. Also, when I try running an NVT simulation with either -pd or -dd, I get the following