History Graph
History Graph
| Commit | Author | Details | Committed | |||
|---|---|---|---|---|---|---|
| f5cf3008dd79 | Axel Kohlmeyer | added new (fast/small) test example for PCFF with ignore flag set | Jan 3 2016 | |||
| 97cd8b401e07 | Axel Kohlmeyer | update reference data for current version of msi2lmp and LAMMPS | Oct 24 2015 | |||
| adfaeadf6376 | Axel Kohlmeyer | add opls-aa test with decane molecules | Oct 24 2015 | |||
| 60d5b70bdd0b | Axel Kohlmeyer | add test case for larger system names | Sep 12 2014 | |||
| d9b8b60b10bd | Axel Kohlmeyer | update data file with pre-style marker versions | Mar 7 2014 | |||
| 7119cc94b4d6 | Axel Kohlmeyer | add second test case with triclinic cell | Mar 7 2014 | |||
| 3ce3bfea5ecd | Axel Kohlmeyer | bugfix for triclinic cells | Mar 7 2014 | |||
| 7c2fee933eca | Axel Kohlmeyer | added new test case for class1 and class2 | Oct 8 2013 | |||
| dbae00bfce44 | Axel Kohlmeyer | import and adapt changes from jeff greathouse to support opls-aa | Aug 2 2013 | |||
| 8e6777342774 | Axel Kohlmeyer | add contributed test for triclinic and clayff | Jul 18 2013 | |||
| 2c0fe147e574 | Axel Kohlmeyer | finish conversion of original reference inputs to new scheme | Jul 12 2013 | |||
| 47fd071935cc | Axel Kohlmeyer | new test added naphthalene | Jul 12 2013 | |||
| 8521abad583a | Axel Kohlmeyer | update class2 reference output for ethane after bugfix | Jul 12 2013 | |||
| 024a29e6ed8d | Axel Kohlmeyer | add set of benzene molecule tests | Jul 12 2013 | |||
| 12c77237fb00 | Axel Kohlmeyer | update reference data after implementing write_data into class2 impropers | Jul 12 2013 | |||
| a52044609033 | Axel Kohlmeyer | update reference data for shifted boxes | Jul 12 2013 | |||
| af632edbf7fc | Axel Kohlmeyer | rename class2 reference files, too | Jul 12 2013 | |||
| 87579249082c | Axel Kohlmeyer | update reference data files with corrected versions | Jul 11 2013 | |||
| 7d9e834df16f | Axel Kohlmeyer | update reference data files to corrected versions | Jul 11 2013 | |||
| 4de9ded00908 | Axel Kohlmeyer | next test example: one hydrogen and one water | Jul 11 2013 | |||
| a47b17026742 | Axel Kohlmeyer | add second test example: water | Jul 11 2013 | |||
| e99ae55b6908 | Axel Kohlmeyer | add new regression test suite for msi2lmp and one pair of tests | Jul 11 2013 |
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