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Commits on May 31, 2017

  1. fixed merge conflict

    committed May 31, 2017
    5e2c9af

  2. Updated to CDK 2.0

    committed May 31, 2017
    c1587c4

  3. Fixed bug in title handling when dealing with disconnected components 

    Bumped version number
    committed May 31, 2017
    f141500
Commits on Aug 15, 2016

  1. bumped project version

    committed Aug 15, 2016
    e53aa2c

  2. Ensure that we carry over the original molecules title if we take the… 

    … largest fragment from a disconnected molecule
    committed Aug 15, 2016
    4f053fd
Commits on Mar 24, 2015

  1. Modified check for format to check for mdl before smi 

    Updated aromaticity code
Bumped version number
Updated to CDK 1.5.10
    committed Mar 24, 2015
    a90c90b
Commits on Oct 24, 2014

  1. Updated test for SMILES format 

    Bumped version numbers
    committed Oct 24, 2014
    374609a
Commits on Oct 10, 2014

  1. Updated help message to list all available fingerprints

    committed Oct 10, 2014
    fa278f3
Commits on May 17, 2014

  1. Allow sig fp's to be outputed as integer array

    committed May 17, 2014
    ed8ccd5
Commits on May 16, 2014

  1. Added params for signature & circ fp's

    committed May 16, 2014
    d6ceafa

  2. bumped version number

    committed May 16, 2014
    7ae5e89
Commits on Apr 9, 2014

  1. Updated deployment to include a local mvn repo that contains our loca… 

    …l lib
    committed Apr 9, 2014
    2dd8619
Commits on Mar 9, 2014

  1. Updated build system to use latest snapshot 

    Removed some exception handling
Bumped version
    committed Mar 9, 2014
    5141c52
Commits on Mar 8, 2014

  1. Specifically included another maven repo for stuff liek commons-cli

    committed Mar 8, 2014
    9b00dd1

  2. Added checkboxtree as a project lib, rather than maven lib

    committed Mar 8, 2014
    31b211b

  3. moved resources to the appropriate place in the maven layout

    committed Mar 8, 2014
    8b9a2c8

  4. removed libs folder since we get deps from maven

    committed Mar 8, 2014
    20f2fa2

  5. removed build.xml since we\'re now mavenized

    committed Mar 8, 2014
    ebc83e3

  6. added a readme

    committed Mar 8, 2014
    9374d52

  7. got mavenized version of project working

    committed Mar 8, 2014
    8bead57

  8. initial steps to mavenization

    committed Mar 8, 2014
    224262a

  9. restructured src dir for maven build

    committed Mar 8, 2014
    4ed8c53

  10. restructured src dir for maven build

    committed Mar 8, 2014
    ac335fb
Commits on Nov 29, 2013

  1. Updated to the latest CDK master

    committed Nov 29, 2013
    b629b8a
Commits on Jan 31, 2013

  1. updated to latest cdk master

    committed Jan 31, 2013
    c7acb8e
Commits on Oct 22, 2012

  1. Updated to latest CDK master. Put in more general logging code. Still… 

    … need to updated all logging messages
    committed Oct 22, 2012
    c2b048b
Commits on Sep 10, 2012

  1. minor update to new fingerprint interfaces

    committed Sep 10, 2012
    3489b73
Commits on Jul 8, 2012

  1. Updated to add more extensive debug output

    committed Jul 8, 2012
    79c42c4
Commits on Jun 12, 2012

  1. Fixed a missing dependency in the big jar

    committed Jun 12, 2012
    cf1d138
Commits on Jun 3, 2012

  1. updated desc selection behavior to create a default initial selection… 

    … of all descriptors
    committed Jun 3, 2012
    345f93e

  2. some changes to make xml explicit when saving selections

    committed Jun 3, 2012
    99fea70

  3. removed idea config file from repo

    committed Jun 3, 2012
    c1baf41

  4. fixed conflicts

    committed Jun 3, 2012
    3c82d1f

  5. fixed cmd line hanling of H

    committed Jun 3, 2012
    ac09836
Commits on Apr 10, 2012

  1. Merge branch 'master' of git@github.com:rajarshi/cdkdescui

    committed Apr 10, 2012
    22b0a42