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Use rdkit from Rust to fragment SMILES
Test #514: Pull request #188 synchronize by prehner
September 15, 2023 06:02 6m 33s fragmentation
September 15, 2023 06:02 6m 33s
Use rdkit from Rust to fragment SMILES
Test #513: Pull request #188 opened by prehner
September 15, 2023 05:32 5m 59s fragmentation
September 15, 2023 05:32 5m 59s
Release v0.5.0
Test #512: Pull request #178 synchronize by prehner
September 4, 2023 15:31 6m 27s v0.5.0
September 4, 2023 15:31 6m 27s
Make f64 the default inner type for all quantities (#186)
Test #511: Commit 5c18ef0 pushed by prehner
September 4, 2023 15:09 6m 16s main
September 4, 2023 15:09 6m 16s
Make f64 the default inner type for all quantities
Test #510: Pull request #186 synchronize by prehner
September 4, 2023 13:44 3m 23s default_type_quantity
September 4, 2023 13:44 3m 23s
Non orthogonal dft (#176)
Test #509: Commit 48ac358 pushed by prehner
September 4, 2023 13:37 6m 23s main
September 4, 2023 13:37 6m 23s
Non orthogonal dft
Test #508: Pull request #176 synchronize by prehner
September 4, 2023 11:29 6m 36s non_orthogonal_dft
September 4, 2023 11:29 6m 36s
Non orthogonal dft
Test #507: Pull request #176 synchronize by prehner
September 4, 2023 10:58 6m 22s non_orthogonal_dft
September 4, 2023 10:58 6m 22s
Non orthogonal dft
Test #506: Pull request #176 synchronize by prehner
September 4, 2023 08:02 6m 33s non_orthogonal_dft
September 4, 2023 08:02 6m 33s
Release v0.5.0
Test #505: Pull request #178 synchronize by prehner
August 31, 2023 11:45 6m 24s v0.5.0
August 31, 2023 11:45 6m 24s
Release v0.5.0
Test #504: Pull request #178 synchronize by prehner
August 29, 2023 12:53 5m 29s v0.5.0
August 29, 2023 12:53 5m 29s
Release v0.5.0
Test #503: Pull request #178 synchronize by prehner
August 23, 2023 11:44 5m 44s v0.5.0
August 23, 2023 11:44 5m 44s
Fix FromSegmentsBinary for Joback (#182)
Test #502: Commit 4b3a0e5 pushed by prehner
August 22, 2023 11:38 7m 11s main
August 22, 2023 11:38 7m 11s
Fix FromSegmentsBinary for Joback
Test #501: Pull request #182 opened by prehner
August 22, 2023 11:35 5m 18s fix_binary_joback
August 22, 2023 11:35 5m 18s
Release v0.5.0
Test #500: Pull request #178 synchronize by prehner
August 22, 2023 11:31 6m 17s v0.5.0
August 22, 2023 11:31 6m 17s
Release v0.5.0
Test #499: Pull request #178 synchronize by prehner
August 8, 2023 12:27 5m 54s v0.5.0
August 8, 2023 12:27 5m 54s
Release v0.5.0
Test #498: Pull request #178 synchronize by prehner
August 8, 2023 12:15 5m 12s v0.5.0
August 8, 2023 12:15 5m 12s
Release v0.5.0
Test #497: Pull request #178 synchronize by prehner
August 8, 2023 11:56 5m 28s v0.5.0
August 8, 2023 11:56 5m 28s
Release v0.5.0
Test #496: Pull request #178 synchronize by prehner
August 8, 2023 11:32 6m 32s v0.5.0
August 8, 2023 11:32 6m 32s
Release v0.5.0
Test #495: Pull request #178 synchronize by prehner
August 7, 2023 19:47 7m 22s v0.5.0
August 7, 2023 19:47 7m 22s
Compile-time checked units (#181)
Test #494: Commit abce022 pushed by prehner
August 7, 2023 19:45 5m 34s main
August 7, 2023 19:45 5m 34s
Compile-time checked units
Test #493: Pull request #181 synchronize by prehner
August 7, 2023 19:39 5m 16s typenum_units
August 7, 2023 19:39 5m 16s
Compile-time checked units
Test #492: Pull request #181 synchronize by prehner
August 7, 2023 18:26 6m 36s typenum_units
August 7, 2023 18:26 6m 36s
Compile-time checked units
Test #491: Pull request #181 synchronize by g-bauer
August 7, 2023 10:03 5m 23s typenum_units
August 7, 2023 10:03 5m 23s