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refine_geom --update_dictionary: support model_Cartn_x CI #185: Commit 8acd733 pushed by keitaroyam
October 4, 2024 13:07 1h 5m 2s main
main
October 4, 2024 13:07 1h 5m 2s
suppress numpy warnings CI #184: Commit c261e24 pushed by keitaroyam
October 1, 2024 08:44 1h 5m 47s main
main
October 1, 2024 08:44 1h 5m 47s
fix mistake 2396595e CI #183: Commit bf614fa pushed by keitaroyam
September 26, 2024 22:24 1h 5m 31s main
main
September 26, 2024 22:24 1h 5m 31s
mmcif: _atom_site.auth_comp_id was requested CI #182: Commit eae5808 pushed by keitaroyam
September 26, 2024 14:07 1h 5m 24s main
main
September 26, 2024 14:07 1h 5m 24s
refine: mixed derivatives between occupancy and ADPs CI #181: Commit b23d7c9 pushed by keitaroyam
September 18, 2024 08:46 1h 10m 45s main
main
September 18, 2024 08:46 1h 10m 45s
geom: symmetry related angle bug fix afa3deae CI #180: Commit ad35012 pushed by keitaroyam
September 13, 2024 14:57 1h 7m 44s v0.4.88
v0.4.88
September 13, 2024 14:57 1h 7m 44s
geom: symmetry related angle bug fix afa3deae CI #179: Commit ad35012 pushed by keitaroyam
September 13, 2024 14:56 1m 12s main
main
September 13, 2024 14:56 1m 12s
fix a bug introduced in 8cc4216d CI #178: Commit 963a8dc pushed by keitaroyam
September 12, 2024 07:58 1h 8m 17s main
main
September 12, 2024 07:58 1h 8m 17s
macos-14 now seems to support python <3.10. ubuntu-24.04 does not sup… CI #177: Commit 3efbe78 pushed by keitaroyam
September 11, 2024 02:48 1h 8m 41s new-gemmi
new-gemmi
September 11, 2024 02:48 1h 8m 41s
switch to gemmi 0.6.7 CI #176: Commit e83852a pushed by keitaroyam
September 8, 2024 23:49 1h 8m 29s new-gemmi
new-gemmi
September 8, 2024 23:49 1h 8m 29s
geom: von Mises type angle restraints (experimental) CI #175: Commit 263a1e0 pushed by keitaroyam
September 5, 2024 12:30 43m 31s main
main
September 5, 2024 12:30 43m 31s
geom: support symmetry in angles CI #174: Commit afa3dea pushed by keitaroyam
September 4, 2024 10:18 43m 39s main
main
September 4, 2024 10:18 43m 39s
test windows CI #173: Commit baa88a5 pushed by keitaroyam
August 29, 2024 02:05 10m 1s test-ci-win
test-ci-win
August 29, 2024 02:05 10m 1s
docs updated CI #172: Commit 41d991f pushed by keitaroyam
August 23, 2024 07:04 45m 29s main
main
August 23, 2024 07:04 45m 29s
ncsr: fix alignment issue CI #171: Commit 9503384 pushed by keitaroyam
August 20, 2024 09:11 54m 3s main
main
August 20, 2024 09:11 54m 3s
refine: print number of pairs for debug CI #170: Commit 6b334be pushed by keitaroyam
August 12, 2024 01:25 54m 15s v0.4.82
v0.4.82
August 12, 2024 01:25 54m 15s
refine: print number of pairs for debug CI #169: Commit 6b334be pushed by keitaroyam
August 12, 2024 01:25 56s main
main
August 12, 2024 01:25 56s
Merge branch 'twin' CI #168: Commit 3269bff pushed by keitaroyam
August 7, 2024 23:30 52m 9s main
main
August 7, 2024 23:30 52m 9s
refine: bug fix for adp restraint with ncs restraint CI #167: Commit 8f78024 pushed by keitaroyam
August 5, 2024 23:01 46m 57s main
main
August 5, 2024 23:01 46m 57s
xtal: R1 is calculated instead of R2, using I/sigma>2 CI #166: Commit cd298ab pushed by keitaroyam
August 1, 2024 09:27 58m 55s main
main
August 1, 2024 09:27 58m 55s
refmacat: suppress warnings from gemmi.prepare_topology in unrestrain… CI #165: Commit b13ea9c pushed by keitaroyam
August 1, 2024 04:51 48m 18s main
main
August 1, 2024 04:51 48m 18s
refine: add --newligand_continue option CI #164: Commit ec16fb3 pushed by keitaroyam
July 20, 2024 08:46 43m 27s v0.4.77
v0.4.77
July 20, 2024 08:46 43m 27s
refine: add --newligand_continue option CI #163: Commit ec16fb3 pushed by keitaroyam
July 20, 2024 08:46 50s main
main
July 20, 2024 08:46 50s
refmacat: write version to mmcif CI #162: Commit 06e538f pushed by keitaroyam
July 18, 2024 13:19 42s v0.4.76
v0.4.76
July 18, 2024 13:19 42s
refmacat: write version to mmcif CI #161: Commit 06e538f pushed by keitaroyam
July 17, 2024 22:14 45m 49s main
main
July 17, 2024 22:14 45m 49s