Messages by Date
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2009/05/29
[Cdk-user] SMARTS Parser
[email protected]
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2009/05/29
Re: [Cdk-user] CSV to SDF conversion
Om
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2009/05/28
Re: [Cdk-user] CSV to SDF conversion
Egon Willighagen
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2009/05/28
[Cdk-user] CSV to SDF conversion
Om
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2009/05/27
[Cdk-user] problem calculating xLogP
陈世林
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2009/05/27
Re: [Cdk-user] Problem using Renderer
gilleain torrance
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2009/05/26
Re: [Cdk-user] Problem using Renderer
Egon Willighagen
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2009/05/26
Re: [Cdk-user] Remove all of a molecule's ChemObjectListeners
Egon Willighagen
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2009/05/26
[Cdk-user] Remove all of a molecule's ChemObjectListeners
Pudney Chris GBJH
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2009/05/26
Re: [Cdk-user] Problem using Renderer
sebi
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2009/05/26
Re: [Cdk-user] Problem using Renderer
Egon Willighagen
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2009/05/26
Re: [Cdk-user] Problem using Renderer
Noel O'Boyle
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2009/05/26
Re: [Cdk-user] Problem using Renderer
gilleain torrance
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2009/05/26
Re: [Cdk-user] Problem while get Molecular Formula
Egon Willighagen
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2009/05/26
Re: [Cdk-user] Problem using Renderer
sebi
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2009/05/26
[Cdk-user] Problem while get Molecular Formula
陈世林
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2009/05/25
[Cdk-user] The CDK 'Don't use this Renderer' 1.2.3 release
Egon Willighagen
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2009/05/23
Re: [Cdk-user] Problem using Renderer
sebi
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2009/05/23
Re: [Cdk-user] Problem using Renderer
gilleain torrance
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2009/05/23
Re: [Cdk-user] Problem using Renderer
sebi
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2009/05/23
Re: [Cdk-user] Problem using Java2DRenderer
Egon Willighagen
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2009/05/23
[Cdk-user] Fwd: SourceForge Community Choice Awards Nominations
Egon Willighagen
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2009/05/22
Re: [Cdk-user] Problem using Java2DRenderer
gilleain torrance
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2009/05/22
Re: [Cdk-user] Problem using Java2DRenderer
Stefan Kuhn
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2009/05/22
[Cdk-user] Problem using Java2DRenderer
sebi
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2009/05/21
Re: [Cdk-user] draw molecule
gilleain torrance
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2009/05/21
Re: [Cdk-user] draw molecule
Egon Willighagen
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2009/05/21
Re: [Cdk-user] draw molecule
JingG
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2009/05/21
Re: [Cdk-user] draw molecule
Angel Herráez
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2009/05/21
Re: [Cdk-user] draw molecule
gilleain torrance
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2009/05/20
Re: [Cdk-user] draw molecule
JingG
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2009/05/20
Re: [Cdk-user] draw molecule
gilleain torrance
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2009/05/20
Re: [Cdk-user] draw molecule
Egon Willighagen
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2009/05/20
Re: [Cdk-user] draw molecule
gilleain torrance
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2009/05/20
Re: [Cdk-user] draw molecule
JingG
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2009/05/20
Re: [Cdk-user] draw molecule
Stefan Kuhn
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2009/05/20
Re: [Cdk-user] Where is the MFAnalyser gone ?
Stefan Kuhn
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2009/05/20
[Cdk-user] draw molecule
JingG
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2009/05/20
[Cdk-user] Where is the MFAnalyser gone ?
pavel willy
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2009/05/15
Re: [Cdk-user] UniversalIsomorphismTester.getSubgraphAtomsMap() not working for small molecules?
Egon Willighagen
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2009/05/15
Re: [Cdk-user] UniversalIsomorphismTester.getSubgraphAtomsMap() not working for small molecules?
Egon Willighagen
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2009/05/15
Re: [Cdk-user] UniversalIsomorphismTester.getSubgraphAtomsMap() not working for small molecules?
Martin Guetlein
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2009/05/15
[Cdk-user] UniversalIsomorphismTester.getSubgraphAtomsMap() not working for small molecules?
Martin Guetlein
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2009/05/15
[Cdk-user] UniversalIsomorphismTester.getSubgraphAtomsMap() not working for small molecules?
Martin Guetlein
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2009/05/09
Re: [Cdk-user] SmilesParser and Chirality
Rajarshi Guha
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2009/05/09
Re: [Cdk-user] SQT, SmilesParser, MDLReader questions
Rajarshi Guha
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2009/05/08
Re: [Cdk-user] SQT, SmilesParser, MDLReader questions
Egon Willighagen
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2009/05/08
Re: [Cdk-user] SQT, SmilesParser, MDLReader questions
Loren Lenzen
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2009/05/08
[Cdk-user] SmilesParser and Chirality
sebastian.klemm
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2009/05/07
Re: [Cdk-user] SQT, SmilesParser, MDLReader questions
Egon Willighagen
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2009/05/07
[Cdk-user] SQT, SmilesParser, MDLReader questions
Loren Lenzen
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2009/05/07
Re: [Cdk-user] Smarts implementation
Rajarshi Guha
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2009/05/07
[Cdk-user] Smarts implementation
Ola Spjuth
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2009/05/05
Re: [Cdk-user] Scaffold generator
Vincent Le Guilloux
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2009/05/05
Re: [Cdk-user] PubChem Fingerprints now available
Christoph Steinbeck
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2009/05/05
Re: [Cdk-user] Scaffold generator
Christoph Steinbeck
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2009/05/04
Re: [Cdk-user] Exception parsing a smiles
Egon Willighagen
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2009/05/04
Re: [Cdk-user] Exception parsing a smiles
Vincent Le Guilloux
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2009/05/04
Re: [Cdk-user] Exception parsing a smiles
Rajarshi Guha
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2009/05/04
[Cdk-user] Structure diagram rendering code migration 1.0.x to 1.2.x
Chris Pudney
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2009/05/04
Re: [Cdk-user] Structure Diagram Generation code migration 1.0.x to 1.2.x
Egon Willighagen
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2009/05/04
[Cdk-user] Structure Diagram Generation code migration 1.0.x to 1.2.x
Chris Pudney
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2009/05/04
[Cdk-user] Exception parsing a smiles
Vincent Le Guilloux
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2009/05/01
Re: [Cdk-user] Error while reading a SD molecule
Egon Willighagen
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2009/05/01
Re: [Cdk-user] Cdk-user Digest, Vol 36, Issue 1
Syed Asad Rahman
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2009/04/30
Re: [Cdk-user] Possible bug in SQT
Rajarshi Guha
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2009/04/30
[Cdk-user] Possible bug in SQT
Loren Lenzen
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2009/04/30
Re: [Cdk-user] Re to Gilleain regarding st2d.java
gilleain torrance
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2009/04/30
Re: [Cdk-user] Calculating Fingerprints
Rajarshi Guha
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2009/04/30
[Cdk-user] Calculating Fingerprints
Beesley, Angela
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2009/04/30
[Cdk-user] Re to Gilleain regarding st2d.java
Beesley, Angela
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2009/04/29
Re: [Cdk-user] Question on Tabular Display of 2D Structures
Egon Willighagen
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2009/04/29
Re: [Cdk-user] substructure searching
Rajarshi Guha
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2009/04/29
Re: [Cdk-user] substructure searching
Loren Lenzen
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2009/04/29
Re: [Cdk-user] Question on Tabular Display of 2D Structures
Rajarshi Guha
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2009/04/29
Re: [Cdk-user] Question on Tabular Display of 2D Structures
gilleain torrance
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2009/04/29
[Cdk-user] Question on Tabular Display of 2D Structures
Beesley, Angela
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2009/04/28
Re: [Cdk-user] Question on descriptors
Rajarshi Guha
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2009/04/28
[Cdk-user] PubChem Fingerprints now available
Egon Willighagen
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2009/04/27
[Cdk-user] Question on descriptors
Beesley, Angela
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2009/04/27
Re: [Cdk-user] active site detection (Was: Scaffold generator)
Rajarshi Guha
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2009/04/27
Re: [Cdk-user] active site detection (Was: Scaffold generator)
Angel Herráez
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2009/04/27
Re: [Cdk-user] Cdk-user Digest, Vol 35, Issue 12
Peter Maas
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2009/04/27
Re: [Cdk-user] Cdk-user Digest, Vol 35, Issue 12
Peter Maas
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2009/04/27
[Cdk-user] Scaffold generator
Vincent Le Guilloux
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2009/04/23
Re: [Cdk-user] substructure searching
Rajarshi Guha
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2009/04/23
[Cdk-user] substructure searching
Loren Lenzen
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2009/04/23
Re: [Cdk-user] Error while reading a SD molecule
Vincent Le Guilloux
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2009/04/22
Re: [Cdk-user] Error while reading a SD molecule
Egon Willighagen
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2009/04/22
Re: [Cdk-user] Error while reading a SD molecule
Rajarshi Guha
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2009/04/22
[Cdk-user] Error while reading a SD molecule
Vincent Le Guilloux
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2009/04/21
[Cdk-user] New Version of SMSD (Small Molecule Subgraph Detector) Available
Syed Asad Rahman
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2009/04/20
[Cdk-user] Planet CDK
Egon Willighagen
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2009/04/17
[Cdk-user] CDK 1.2.1 released
Egon Willighagen
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2009/04/15
Re: [Cdk-user] SMARTS implementation
Thomas Kuhn
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2009/04/15
[Cdk-user] CDK Workshop Web Coverage KickOff
Egon Willighagen
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2009/04/09
[Cdk-user] SMARTS implementation
Loren Lenzen
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2009/04/08
Re: [Cdk-user] JOElib converter
Vincent Le Guilloux
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Christoph Steinbeck
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Noel O'Boyle
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2009/04/07
Re: [Cdk-user] SMILESwriter can write canonical SMILES?
Rajarshi Guha
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2009/04/07
Re: [Cdk-user] SMILESwriter can write canonical SMILES?
Egon Willighagen
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2009/04/07
Re: [Cdk-user] SMILESwriter can write canonical SMILES?
Egon Willighagen
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2009/04/07
Re: [Cdk-user] SMILESwriter can write canonical SMILES?
Nina Jeliazkova
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Egon Willighagen
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Stefan Kuhn
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Christoph Steinbeck
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Egon Willighagen
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2009/04/07
Re: [Cdk-user] Detect stereocenters of a molecule
Stefan Kuhn
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2009/04/07
[Cdk-user] Detect stereocenters of a molecule
Ola Spjuth
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2009/04/04
Re: [Cdk-user] [Jmol-users] Jmol + cdk
Egon Willighagen
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2009/03/31
[Cdk-user] RingAtom class & NPE
P D
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2009/03/30
Re: [Cdk-user] installing CDK on centOS 4
Egon Willighagen
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2009/03/30
Re: [Cdk-user] installing CDK on centOS 4
Rajarshi Guha
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2009/03/30
[Cdk-user] installing CDK on centOS 4
Emilio Xavier Esposito
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2009/03/29
Re: [Cdk-user] RingAtom class & NPE
Rajarshi Guha
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2009/03/29
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Rajarshi Guha
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2009/03/28
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Egon Willighagen
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2009/03/27
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Markus Hartenfeller
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2009/03/27
[Cdk-user] RingAtom class & NPE
P D
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2009/03/26
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Egon Willighagen
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2009/03/26
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Markus Hartenfeller
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2009/03/26
Re: [Cdk-user] switch off firing of ChemObjectChangeEvent
Egon Willighagen
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2009/03/26
[Cdk-user] switch off firing of ChemObjectChangeEvent
Markus Hartenfeller
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2009/03/24
Re: [Cdk-user] SMILESwriter can write canonical SMILES?
Christoph Steinbeck
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2009/03/24
[Cdk-user] SMILESwriter can write canonical SMILES?
Noel O'Boyle
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2009/03/20
Re: [Cdk-user] [Cdk-devel] CDK Nightly Builds now served by EBI
Rajarshi Guha
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2009/03/20
[Cdk-user] CDK Nightly Builds now served by EBI
Christoph Steinbeck
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2009/03/17
[Cdk-user] 2nd Call for registration: CDK workshop in Hinxton, Cambridge, on April 20/21, 2009
Christoph Steinbeck
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2009/03/13
[Cdk-user] CDK 1.2.0 released; 1.0 EOL; SVN -> Git
Egon Willighagen
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2009/03/09
Re: [Cdk-user] 2D Depiction Coordinates
Alexander Klenner
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2009/03/09
[Cdk-user] 2D Depiction Coordinates
Alexander Klenner
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2009/03/03
[Cdk-user] SSSRFinder
Markus Hartenfeller
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Egon Willighagen
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Vincent Le Guilloux
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Alexander Klenner
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Egon Willighagen
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Markus Hartenfeller
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Angel Herraez
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Christoph Steinbeck
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2009/03/03
Re: [Cdk-user] 2D depiction and MDL reader
Egon Willighagen
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2009/03/03
[Cdk-user] 2D depiction and MDL reader
Vincent Le Guilloux
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2009/02/25
[Cdk-user] Open posisitions at EBI (related to Open Source, Open Data)
Christoph Steinbeck
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2009/02/24
Re: [Cdk-user] JOElib converter
Egon Willighagen
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2009/02/24
Re: [Cdk-user] JOElib converter
Vincent Le Guilloux
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2009/02/24
Re: [Cdk-user] JOElib converter
Egon Willighagen
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2009/02/24
Re: [Cdk-user] JOElib converter
Stefan Kuhn
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2009/02/24
Re: [Cdk-user] JOElib converter
Rajarshi Guha
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2009/02/24
Re: [Cdk-user] JOElib converter
Vincent Le Guilloux
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2009/02/24
Re: [Cdk-user] JOElib converter
Egon Willighagen
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2009/02/24
[Cdk-user] JOElib converter
Vincent Le Guilloux
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2009/02/17
[Cdk-user] compiling cdk 1.1.5 on osx
gilleain torrance
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2009/02/17
Re: [Cdk-user] problem installing cdk
David Lagorce
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2009/02/17
[Cdk-user] CDK Workshop at EBI on April 20/21
Christoph Steinbeck
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2009/02/17
Re: [Cdk-user] problem installing cdk
Egon Willighagen
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2009/02/17
Re: [Cdk-user] problem installing cdk
David Lagorce
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2009/02/16
Re: [Cdk-user] jsMolEditor preview 0.2 is available for download now.
Angel Herraez
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2009/02/16
Re: [Cdk-user] Clever libraries
Andreas Schueller
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2009/02/16
Re: [Cdk-user] jsMolEditor preview 0.2
Angel Herraez
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2009/02/15
Re: [Cdk-user] jsMolEditor preview 0.2 is available for download now.
Christoph Steinbeck
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2009/02/15
Re: [Cdk-user] problem installing cdk
Rajarshi Guha
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2009/02/15
Re: [Cdk-user] problem installing cdk
Rajarshi Guha
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2009/02/15
Re: [Cdk-user] problem installing cdk
Egon Willighagen
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2009/02/15
Re: [Cdk-user] problem installing cdk
David Lagorce
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2009/02/15
Re: [Cdk-user] problem installing cdk
Egon Willighagen
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2009/02/15
Re: [Cdk-user] problem installing cdk
David Lagorce
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2009/02/15
Re: [Cdk-user] problem installing cdk
Egon Willighagen
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2009/02/15
Re: [Cdk-user] jsMolEditor preview 0.2 is available for download now.
Egon Willighagen
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2009/02/14
[Cdk-user] problem installing cdk
David Lagorce
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2009/02/14
[Cdk-user] jsMolEditor preview 0.2 is available for download now.
Duan Lian
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2009/02/13
[Cdk-user] Clever libraries
Christoph Steinbeck
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2009/02/10
Re: [Cdk-user] CDK 1.2 Release Candidate
Andreas Schueller
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2009/02/10
Re: [Cdk-user] CDK 1.2 Release Candidate - Maven release
Sam Adams
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2009/02/10
[Cdk-user] CDK 1.2 Release Candidate
Egon Willighagen
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2009/01/29
[Cdk-user] DeduceBondSystemTool performance
Peter Maas
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2009/01/28
[Cdk-user] PhD position in Computational Structural Biology at Cambridge, UK
Swanand Gore
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2009/01/14
Re: [Cdk-user] 2D depictions
Egon Willighagen
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2009/01/13
Re: [Cdk-user] 2D depictions
Rajarshi Guha
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2009/01/12
Re: [Cdk-user] 2D depictions
Egon Willighagen
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2009/01/12
[Cdk-user] 2D depictions
Rajarshi Guha
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2009/01/09
Re: [Cdk-user] help with implementing VicinitySampler
Christoph Steinbeck
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2009/01/08
Re: [Cdk-user] help with implementing VicinitySampler
Christoph Steinbeck
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2009/01/08
[Cdk-user] help with implementing VicinitySampler
Ketterer, Matthew James
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2008/12/22
Re: [Cdk-user] AJAX Based Molecule Editor, anyone interested in that?
Egon Willighagen
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2008/12/22
Re: [Cdk-user] Fwd: CCL: SMILES to VRML or X3D
Josep Cester Bofarull
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2008/12/22
[Cdk-user] AJAX Based Molecule Editor, anyone interested in that?
Duan Lian
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2008/12/19
[Cdk-user] Fwd: CCL: SMILES to VRML or X3D
Rajarshi Guha
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2008/12/19
Re: [Cdk-user] rotatable bonds
Egon Willighagen
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2008/12/19
Re: [Cdk-user] rotatable bonds
Peter Maas
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2008/12/19
Re: [Cdk-user] rotatable bonds
Egon Willighagen
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2008/12/19
[Cdk-user] rotatable bonds
Peter Maas
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2008/11/24
[Cdk-user] [UPDATE] Status CDK 1.2.x
Egon Willighagen
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2008/11/22
Re: [Cdk-user] molecule images from MDL files
Adel Golovin
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Egon Willighagen
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Adel Golovin
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Rajarshi Guha
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Egon Willighagen
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Adel Golovin
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2008/11/21
Re: [Cdk-user] molecule images from MDL files
Angel Herraez
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2008/11/21
Re: [Cdk-user] Parser went wrong dealing with aromatic SMILES
Noel O'Boyle