source:
tests/regression/Atoms/Add/post@
0096a40
| Name | Size | Rev | Age | Author | Last Change |
|---|---|---|---|---|---|
| ../ | |||||
| test.xyz | 65 bytes | d445e4 | 14 years | Changed regression testsuite structure of Atoms. - All atom-related … | |
| test.pdb | 143 bytes | ceaab1 | 9 years | AddAtom now adds a molecule (atom always associated with a molecule). … | |
| test.in | 429 bytes | e3c4c5 | 10 years | MpqcParser additionally allows to save optimization jobs. - this is … | |
| test.data | 221 bytes | e6e4a0 | 13 years | FIX: TremoloParser did not treat key F properly in saveLine() and … | |
| test.conf | 3.5 KB | d445e4 | 14 years | Changed regression testsuite structure of Atoms. - All atom-related … | |
| empty.conf | 3.3 KB | f73351 | 12 years | FIX: Some Thermostats would cause NaN on zero temperature. - … | |
|
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