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Reorganize _Atom struct to use less memory Test #29: Commit b456a1d pushed by althonos
April 18, 2024 10:05 2m 11s main
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April 18, 2024 10:05 2m 11s
Rename tests for Template and TemplateAtom classes Test #28: Commit f54730e pushed by althonos
April 18, 2024 09:55 2m 20s main
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April 18, 2024 09:55 2m 20s
Add trailing NUL to line to parse in TemplateAtom.loads Test #27: Commit e29982e pushed by althonos
April 18, 2024 09:10 2m 28s main
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April 18, 2024 09:10 2m 28s
Display lin in error message for parsing errors Test #26: Commit 42877ea pushed by althonos
April 18, 2024 09:02 2m 26s main
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April 18, 2024 09:02 2m 26s
Fix additional code issues in _jess.pyx Test #25: Commit 4d45988 pushed by althonos
April 18, 2024 08:41 2m 15s main
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April 18, 2024 08:41 2m 15s
Update TessAtom.c to support compilation on Windows Test #24: Commit 72089ee pushed by althonos
April 18, 2024 08:32 2m 20s main
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April 18, 2024 08:32 2m 20s
Bump coverage used in GitHub Actions to v7.0 Test #23: Commit e6a8a92 pushed by althonos
April 18, 2024 08:25 2m 15s main
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April 18, 2024 08:25 2m 15s
Attempt fixing compilation issues on Windows Test #22: Commit b375947 pushed by althonos
April 18, 2024 08:16 2m 33s main
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April 18, 2024 08:16 2m 33s
Add test using Jess gold standard checking for an MCSA template Test #21: Commit fcbdd61 pushed by althonos
April 17, 2024 23:10 2m 45s main
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April 17, 2024 23:10 2m 45s
Enable uploading coverage reports to Codecov Test #20: Commit 24d2161 pushed by althonos
April 17, 2024 17:06 2m 51s main
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April 17, 2024 17:06 2m 51s
Enable uploading coverage reports to Codecov Test #19: Commit 039f16b pushed by althonos
April 17, 2024 17:04 Failure main
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April 17, 2024 17:04 Failure
Fix copying of string data from Python to C structs Test #18: Commit 37dea60 pushed by althonos
April 16, 2024 20:46 2m 39s main
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April 16, 2024 20:46 2m 39s
Fix return of exception TemplateAtom.loads Test #17: Commit f3038aa pushed by althonos
April 16, 2024 20:09 2m 46s main
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April 16, 2024 20:09 2m 46s
Fix use of strncpy and memset in Molecule.__init__ Test #16: Commit 53a069a pushed by althonos
April 16, 2024 20:03 2m 25s main
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April 16, 2024 20:03 2m 25s
Add missing include of <math.h> header in patched TessAtom.c Test #15: Commit 8bbf4ba pushed by althonos
April 16, 2024 18:13 3m 4s main
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April 16, 2024 18:13 3m 4s
Add missing test PDB file in pyjess.tests.data Test #14: Commit 5ed31e8 pushed by althonos
April 16, 2024 18:10 2m 36s main
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April 16, 2024 18:10 2m 36s
Allow passing an identifier to Template.loads Test #13: Commit f32b515 pushed by althonos
April 16, 2024 18:04 2m 9s main
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April 16, 2024 18:04 2m 9s
Fix Atom and TessAtom handling of atom names for consistency with… Test #12: Commit 7edc16b pushed by althonos
April 16, 2024 18:00 2m 11s main
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April 16, 2024 18:00 2m 11s
Update licensing information in README.md Test #11: Commit a187fc9 pushed by althonos
April 16, 2024 17:12 2m 11s main
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April 16, 2024 17:12 2m 11s
Fix out-of-bounds write when creating an empty Template Test #10: Commit 84297f3 pushed by althonos
April 16, 2024 17:07 2m 16s main
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April 16, 2024 17:07 2m 16s
Add tests for Jess using conserved atoms only Test #9: Commit 1c1703a pushed by althonos
April 12, 2024 11:13 2m 56s main
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April 12, 2024 11:13 2m 56s
Add tests for Jess output comparing to output from CLI Test #8: Commit 97033d1 pushed by althonos
April 12, 2024 10:51 2m 8s main
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April 12, 2024 10:51 2m 8s
Implement Molecule.load to load a molecule from a PDB file Test #7: Commit 9498e29 pushed by althonos
April 12, 2024 09:26 3m 24s main
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April 12, 2024 09:26 3m 24s
Add missing Atom import in main namespace Test #6: Commit 25f7889 pushed by althonos
April 11, 2024 22:01 3m 1s main
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April 11, 2024 22:01 3m 1s
Update test.yml Actions workflow to run Python unit tests Test #5: Commit 79f4634 pushed by althonos
April 11, 2024 21:38 2m 37s main
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April 11, 2024 21:38 2m 37s