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- 02:00 PM GROMACS Bug #2148 (Feedback wanted): gmx solvate crashing or leaving gaps for hexagonal solvent box
- The latter linked change should "fix" this by giving a fatal error for cases that gmx solvate does not support (and n...
- 03:32 PM GROMACS Revision 44909a43: Avoid some incorrect behavior with gmx solvate
- gmx solvate cannot replicate non-rectangular solvent boxes correctly
(there are several different places that assume ...
- 03:30 PM GROMACS Revision b15c09b2: Remove pbcutil <-> mdtypes cyclic dependency
- This may not be the cleanest solution, but it separates the
responsibilities of having knowledge of t_state and t_inp...
- 08:11 PM GROMACS Bug #2184 (Fix uploaded): make install-guide fails
- 04:48 PM GROMACS Revision 2a57fccf: Generalize command-line test output file checking
- Add a separate interface that gets passed a path to the temporary file
created by the program under test, instead of ...
- 07:09 AM Support Platforms Task #2161: update the way testing matrices are specified
- I would suggest avoiding branching of the releng scripts; that likely leads to more extra maintenance than it is wort...
- 10:08 AM GROMACS Task #2168: Design for multiple comparisons against same test reference data
- Now, what is it that you want to test with this particular structure? That the CPU and GPU paths produce the same res...
- 12:32 PM GROMACS Revision 7fc30699: Consistent approach for whole-program tests
- All tests that essentially execute one command-line program as the test
are now using CommandLineTestBase, which make...
- 06:36 PM GROMACS Revision 9d557948: Improve key-value tree gmx dump support
- Add test coverage for basic option types with the functionality used by
gmx dump, and implement missing types. Move ...
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