Re: [gmx-users] single vs double precision issues

2007-09-18 Thread David van der Spoel
Adrien Leygue wrote: Dear Gromacs users, I am experiencing several problems which all seem to relate to single vs. double precision. 1-) I am doing simulations of a liquid crystal system using a custom force field but whenever I try to run them in parallel they all crash after some time (238 ps

[gmx-users] single vs double precision issues

2007-09-18 Thread Adrien Leygue
Dear Gromacs users, I am experiencing several problems which all seem to relate to single vs. double precision. 1-) I am doing simulations of a liquid crystal system using a custom force field but whenever I try to run them in parallel they all crash after some time (238 ps) unless I run them in