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Commits on Sep 11, 2025

• Fixes #8712 (#8736)

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  ricrogz

  authored
  6da61ce

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Commits on Sep 3, 2025

• Fixes #8689 (#8738)

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  greglandrum

  and

  ricrogz

  authored
  6d8fca2

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Commits on Aug 29, 2025

• Expose CDX support to FileParsers and ChemDraw to SWIG (#8681)

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  bp-kelley

  and

  Brian Kelley

  authored
  cf269aa

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Commits on Aug 28, 2025

• patch the pubchem alignment code (#8733)

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  greglandrum

  authored
  dbd9724

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Commits on Aug 27, 2025

• CanonicalizeConformer inverts structure (#8734)

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  DavidACosgrove

  and

  David Cosgrove

  authored
  d54d0c5

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• Fixes a bug with bad H positions in output conformer (#8731)

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  greglandrum

  authored
  81226d8

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Commits on Aug 25, 2025

• Add the useRingTemplates option to generateDepictionMatching2DStructure (#8688)

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  ricrogz

  authored
  be2b189

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• - expose RDK_BUILD_MINIMAL_LIB_RGROUPDECOMP in Code/MinimalLib/CMakeLists.txt (#8729)

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  ptosco

  and

  ptosco

  authored
  dd04452

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• document the way the 2D/3D flag in ctabs is handled (#8722)

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  greglandrum

  and

  ricrogz

  authored
  b35ecc1

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• Update documentation for rdShapeAlign.AlignMol opt_param (#8724)

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  priley-vv

  authored
  4cc9d6f

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Commits on Aug 20, 2025

• Fix for Issue 8602 (#8668)

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  tadhurst-cdd

  authored
  3f60cb5

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Commits on Aug 16, 2025

• Fixes #7215 (#8710)

  greglandrum

  authored
  52d8bd0

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Commits on Aug 15, 2025

• increase max time for win64 CI builds (#8709)

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  greglandrum

  authored
  76c813c

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• Fix drawing of very short arcs in lasso. (#8706)

  DavidACosgrove

  authored
  f90b438

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Commits on Aug 14, 2025

• Disable ChemDraw support by default (#8707)

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  bp-kelley

  and

  Brian Kelley

  authored
  7da14fb

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• Fix offsets for DrawMoleculeWithHighlights. (#8680)

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  DavidACosgrove

  and

  David Cosgrove

  authored
  b9666d9

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• Fix build with Boost 1.89.0 (#8694)

  cho-m

  authored
  db53785

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Commits on Aug 12, 2025

• Fixes #7264 (#8696)

  greglandrum

  authored
  4007e0c

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Commits on Aug 11, 2025

• Fix parse error messages for bad characters (#8675)

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  whosayn

  authored
  9b73ebf

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• explicitly set COMPOSE_BAKE to false (#8693)

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  ptosco

  and

  ptosco

  authored
  4200829

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Commits on Aug 10, 2025

• Fix documentation errors for rdShapeAlign (#8685)

  badisa

  authored
  53a0143

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Commits on Jul 30, 2025

• Fixes #8654 (#8657)

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  greglandrum

  authored
  ccefda8

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Commits on Jul 25, 2025

• Fix #8638 (#8639)

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  padix-key

  and

  greglandrum

  authored
  c20b2a9

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• Fixes Github8650 - spaces in columns in tab-separated synthon space files (#8652)

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  DavidACosgrove

  and

  David Cosgrove

  authored
  34e80ab

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Commits on Jul 24, 2025

• Add option to draw all CIP codes in DrawMol.cpp (#8609)

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  paconius

  authored
  1fe07a5

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• Fix Rascal out of memory bug. (#8648)

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  DavidACosgrove

  and

  David Cosgrove

  authored
  e712d20

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Commits on Jul 23, 2025

• Expose reading/writing PNG metadata to CFFI and MinimalLib (#8381)

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  ptosco

  and

  ptosco

  authored
  9c7ffb3

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Commits on Jul 22, 2025

• Fixes #8569 (#8588)

  ptosco

  authored
  3542b3f

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Commits on Jul 21, 2025

• Mem fixes (#8640)

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  ricrogz

  authored
  397d19e

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Commits on Jul 18, 2025

• Switch a bunch of C++ tests to use catch2 (#8625)

  greglandrum

  authored
  ebd7dad

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Commits on Jul 17, 2025

• fix a typo (#8636)

  greglandrum

  authored
  bf44cdb

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• Fixes CI: Force conda-forge channel, ignore defaults/anaconda repos (#8630)

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  bp-kelley

  authored
  40f851d

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Commits on Jul 16, 2025

• Update SMARTS parsing syntax error to include bad token position (#8610)

  whosayn

  authored
  82586a0

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Commits on Jul 13, 2025

• Fixes #8586 (#8604)

  greglandrum

  authored
  768a71a

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• Scsr sgroup error (#8623)

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  tadhurst-cdd

  and

  greglandrum

  authored
  9055646

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