| commit | 4dcb2a1aec05ca4fe50492007251ccd9e31b948a | |
| author | Paul Bauer <paul.bauer.q@gmail.com> | |
| Mon, 29 Oct 2018 11:24:06 +0000 (29 12:24 +0100) | ||
| committer | Mark Abraham <mark.j.abraham@gmail.com> | |
| Thu, 8 Nov 2018 21:25:17 +0000 (8 22:25 +0100) | ||
| tree | 925e065b516d0ffe59929df251bf3e60510076e1 | treesnapshot (tar.gz zip) |
| parent | 93bea6f4ccc34e24c69647e77e560b9100a55831 | commitdiff |
Issue fatal error if checkpoint does not suit the .tpr
If the step number in the checkpoint is out of range for that
described in the .tpr, then the user has provided mismatching
inputs. We do not intend then to be able to address this with the
mdrun -nsteps option.
Fixes #2717
Change-Id: I827bdc1b92ee69bf6287e2fd552ace7583b62028
If the step number in the checkpoint is out of range for that
described in the .tpr, then the user has provided mismatching
inputs. We do not intend then to be able to address this with the
mdrun -nsteps option.
Fixes #2717
Change-Id: I827bdc1b92ee69bf6287e2fd552ace7583b62028
| docs/release-notes/2018/2018.4.rst | diffblobblamehistory | |
| src/gromacs/fileio/checkpoint.cpp | diffblobblamehistory |