| commit | 4d5a539686b6c5b48a21d407ff4bf60104466a99 | |
| author | Mark Abraham <Mark.J.Abraham@gmail.com> | |
| Wed, 2 Feb 2011 04:48:20 +0000 (2 15:48 +1100) | ||
| committer | Mark Abraham <Mark.J.Abraham@gmail.com> | |
| Wed, 2 Feb 2011 04:48:20 +0000 (2 15:48 +1100) | ||
| tree | 9ae7221bf48f0d2ad146a322775d493e443a9060 | treesnapshot (tar.gz zip) |
| parent | 4d200dc02260805cbcf8ce0fad0bca682e13f946 | commitdiff |
Fixed minor issue with replica exchange
If the user chose mdrun -replex that was not a multiple of
nstcalcenergy, then replica exchange could occur when energies were
not current. Fixed by requiring repl_ex_nst to be a multiple of
nstcalcenergy, as with similar mechanisms for global
intra-simulation communication.
IssueID #695
If the user chose mdrun -replex that was not a multiple of
nstcalcenergy, then replica exchange could occur when energies were
not current. Fixed by requiring repl_ex_nst to be a multiple of
nstcalcenergy, as with similar mechanisms for global
intra-simulation communication.
IssueID #695
| src/kernel/md.c | diffblobblamehistory |