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Commits on Sep 2, 2016

• Dev/doc updates 2 sept (#1055)

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  greglandrum

  authored
  4d17f8a

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Commits on Sep 1, 2016

• Fixes #1049 (#1050)

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  greglandrum

  authored
  f0bb85d

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Commits on Aug 30, 2016

• Fixes issue #1021 (#1026)

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  greglandrum

  authored and

  bp-kelley

  committed
  91674e6

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• Fixes #1034: squiggle bonds are now preserved if no sanitization is done (#1043)

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  greglandrum

  authored and

  bp-kelley

  committed
  8009b86

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Commits on Aug 19, 2016

• Added the option to label deuterium and tritium as D and T (#1011)

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  ptosco

  authored and

  greglandrum

  committed
  87b69a7

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Commits on Aug 18, 2016

• fixes #1023 (#1027)

  

  greglandrum

  authored and

  bp-kelley

  committed
  7a49dd3

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Commits on Aug 17, 2016

• Cause ImportError from failed dlopen of the rdBase.so shared library to propagate. (#1032)

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  coleb

  authored and

  greglandrum

  committed
  009dd58

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• FMCS fix for Windows DLLs (#1030)

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  ptosco

  authored and

  greglandrum

  committed
  a5699d9

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• Adds replaceCore function that takes a matchVect (#1013)

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  bp-kelley

  authored and

  greglandrum

  committed
  71a0ae3

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Commits on Aug 16, 2016

• Add an initial version of wavy bonds (#1014)

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  greglandrum

  authored
  ddb13ec

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Commits on Aug 13, 2016

• Make the Contrib directory available in RDConfig (#1024)

  

  NadineSchneider

  authored and

  greglandrum

  committed
  494cef8

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Commits on Aug 11, 2016

• - fixes #1018 (#1020)

  

  ptosco

  authored and

  greglandrum

  committed
  0406520

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• fix non-inchi build (#1018)

  greglandrum

  authored
  cb85329

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• remove a compiler warning (#1019)

  greglandrum

  authored
  003ede5

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• Adds Atom atom map and rlabel apis (#1004)

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  bp-kelley

  authored and

  greglandrum

  committed
  ddf7c73

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Commits on Aug 10, 2016

• added an implementation of the Gobbi Atom-Atom-Path (AAP) similarity metric (#1015)

  

  Richard-Hall

  authored and

  greglandrum

  committed
  9768025

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Commits on Aug 9, 2016

• fix compatibility issues with postgres < 9.5 (#1000) (#1005)

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  rvianello

  authored and

  greglandrum

  committed
  dbe694b

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• Dev/chemtransforms chirality (#1006)

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  bp-kelley

  authored and

  greglandrum

  committed
  fe7d4fe

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Commits on Aug 8, 2016

• Fix Inchi being hardcoded into PostgreSQL (#1009)

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  ptosco

  authored and

  greglandrum

  committed
  5d3bb11

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• Support ETKDG from within the SWIG wrappers (#1010)

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  greglandrum

  authored
  cb71034

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Commits on Aug 6, 2016

• Fixes MMFF94 aromaticity perception and ChemicalForceFields.MMFFHasAllMoleculeParams() (#1007)

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  ptosco

  authored and

  greglandrum

  committed
  7aa42e3

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Commits on Aug 5, 2016

• Fixes #962 (#1003)

  

  greglandrum

  authored and

  bp-kelley

  committed
  7fd991e

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• - fixes typo which breaks the PostgreSQL cartridge build on Windows (#1008)

  

  ptosco

  authored and

  greglandrum

  committed
  41d415a

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Commits on Aug 2, 2016

• try and resolve intermittent travis build problems

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  greglandrum

  authored
  df0036c

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• Fixes middle-justified symbols in sd files, adds M_CHG tests (#1002)

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  bp-kelley

  authored and

  greglandrum

  committed
  900fc39

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• Fixes rounding errors in test (#1001)

  

  bp-kelley

  authored and

  greglandrum

  committed
  7440ac0

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Commits on Aug 1, 2016

• fix a cartridge test broken by #986

  greglandrum

  committed
  b9fbd0b

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• refactoring of the postgresql cartridge (#992)

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  rvianello

  authored and

  greglandrum

  committed
  b0bba54

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Commits on Jul 29, 2016

• - fixed a few slashes in a Linux path (#997)

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  ptosco

  authored and

  greglandrum

  committed
  aa763c4

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Commits on Jul 27, 2016

• ChemReactions: Bugfix in copy constructor (#996)

  

  NadineSchneider

  authored and

  bp-kelley

  committed
  61ca812

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• - RCSB SDF files which feature right-justified element names can now be parsed (#994)

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  ptosco

  authored and

  greglandrum

  committed
  63b6bde

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• Merge fix/github908 branch

  greglandrum

  committed
  339fa08

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Commits on Jul 26, 2016

• Fixes #987 (#988)

  

  greglandrum

  authored and

  bp-kelley

  committed
  7ef4b02

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• Expose the aromatizeIfPossible parameter to python (#991)

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  greglandrum

  authored and

  bp-kelley

  committed
  435a34d

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Commits on Jul 25, 2016

• A variety of drawing-related changes (#986)

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  greglandrum

  authored and

  bp-kelley

  committed
  91212a4

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