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docs: conditionally skip testcode that depends on NumP0 CI #1359: Commit 020a202 pushed by wojdyr
7m 4s master
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make tests run also without NumPy CI #1358: Commit 83486d4 pushed by wojdyr
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FlatStructure CI #1357: Commit 160029f pushed by wojdyr
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more changes to DSSP (now mostly from Claude Sonnet and Opus) CI #1356: Commit 3934683 pushed by wojdyr
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changes to DSSP (proposed and applied by agent gemini-2.5-pro) CI #1355: Commit c175414 pushed by wojdyr
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gemmi-h: add option --d-fract=FRACT (#385) CI #1354: Commit 366c3e9 pushed by wojdyr
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dssp - hydrogen bonds are calcualted CI #1353: Commit 2a2cdea pushed by wojdyr
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CodeQL CodeQL #137: Scheduled
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add function populate_structure_from_block() (#383) CI #1352: Commit 1197bae pushed by wojdyr
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gemmi-contact: add option --asus (#365) CI #1351: Commit d52e79d pushed by wojdyr
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gemmi-convert --assembly --shorten: use HowToNameCopiedChain::Short CI #1350: Commit 0d44cc0 pushed by wojdyr
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add_hydrogens_without_positions(): tweak how occupancies of neighbouring CI #1349: Commit 9d7c372 pushed by wojdyr
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resinfo.cpp: add 6 PYR residues (#382) CI #1348: Commit b86be9f pushed by wojdyr
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CodeQL CodeQL #136: Scheduled
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prog/monlib_opt.h: avoid using uninitialized variable CI #1347: Commit f9fef41 pushed by wojdyr
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python/chemcomp.cpp: bindings for one more property CI #1346: Commit c0d2126 pushed by wojdyr
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Intensities::merged() -> Intensities (as an alternative to merge_in_… CI #1345: Commit db05344 pushed by wojdyr
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to_mmcif: add _struct_ref_seq.pdbx_PDB_id_code and _struct_ref_seq.pd… CI #1344: Commit 6a0e000 pushed by wojdyr
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to_mmcif: populate more items in _struct_ref_seq. CI #1343: Commit 7032354 pushed by wojdyr
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add the recently added file to pyproject.toml and CMakeLists.txt CI #1342: Commit 6cc450f pushed by wojdyr
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add the recently added file to pyproject.toml and CMakeLists.txt CI #1341: Commit f4c4923 pushed by wojdyr
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add recently added file to pyproject.toml CI #1340: Commit b911415 pushed by wojdyr
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new link to the pdbcur documentation CI #1339: Commit 1e318fb pushed by wojdyr
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copy fetch.py afterwards (otherwise it confused stubgen) CI #1338: Commit 8d02b10 pushed by wojdyr
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tests/test_fetch.py - skip rather than fail on connection problems CI #1337: Commit c16f316 pushed by wojdyr
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