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• • Re: [Cdk-user] Strange SMILES produced by CDK Rajarshi Guha
  • Re: [Cdk-user] Strange SMILES produced by CDK Charlie Zhu
  • Re: [Cdk-user] Strange SMILES produced by CDK Rajarshi Guha
  • Re: [Cdk-user] Strange SMILES produced by CDK Charlie Zhu
  • Re: [Cdk-user] Strange SMILES produced by CDK Dmitry Pavlov
• [Cdk-user] 30 min for PEOE Partial Charge calculation Gwenael Chevé
• Re: [Cdk-user] SMARTS question (Rajarshi Guha) Loren Lenzen
  • Re: [Cdk-user] SMARTS question (Rajarshi Guha) Rajarshi Guha
• [Cdk-user] Hydrogen atomic number is null Vincent Le Guilloux
  • Re: [Cdk-user] Hydrogen atomic number is null Egon Willighagen
• Re: [Cdk-user] Cdk-user Digest, Vol 42, Issue 4 Aziz Yasri
• [Cdk-user] Wrong atom types assignements Aziz Yasri
• [Cdk-user] SMARTS question Mark Rijnbeek
  • Re: [Cdk-user] SMARTS question Rajarshi Guha
  • Re: [Cdk-user] SMARTS question Mark Rijnbeek
  • Re: [Cdk-user] SMARTS question Egon Willighagen
  • Re: [Cdk-user] SMARTS question Rajarshi Guha
  • Re: [Cdk-user] SMARTS question Mark Rijnbeek
  • Re: [Cdk-user] SMARTS question Rajarshi Guha
  • Re: [Cdk-user] SMARTS question Mark Rijnbeek
  • Re: [Cdk-user] SMARTS question Rajarshi Guha
  • Re: [Cdk-user] SMARTS question Rajarshi Guha
• [Cdk-user] Aromatization & SDF bond type Vincent Le Guilloux
  • Re: [Cdk-user] Aromatization & SDF bond type Rajarshi Guha
  • Re: [Cdk-user] Aromatization & SDF bond type Vincent Le Guilloux
  • Re: [Cdk-user] Aromatization & SDF bond type Nina Jeliazkova
  • Re: [Cdk-user] Aromatization & SDF bond type Egon Willighagen
  • Re: [Cdk-user] Aromatization & SDF bond type Vincent Le Guilloux
  • [Cdk-user] CDK descriptors list Vincent Le Guilloux
  • Re: [Cdk-user] CDK descriptors list Rajarshi Guha
  • Re: [Cdk-user] CDK descriptors list Vincent Le Guilloux
  • Re: [Cdk-user] CDK descriptors list Rajarshi Guha
  • [Cdk-user] NaN values for some WHIM descriptors Vincent Le Guilloux
  • Re: [Cdk-user] NaN values for some WHIM descriptors Rajarshi Guha
  • Re: [Cdk-user] NaN values for some WHIM descriptors Vincent Le Guilloux
  • Re: [Cdk-user] NaN values for some WHIM descriptors Rajarshi Guha
  • [Cdk-user] SDF writer problem Vincent Le Guilloux
  • Re: [Cdk-user] Aromatization & SDF bond type Rajarshi Guha
  • Re: [Cdk-user] Aromatization & SDF bond type Egon Willighagen
• [Cdk-user] making a chemical database ramakaalia
  • Re: [Cdk-user] making a chemical database Stefan Kuhn
  • Re: [Cdk-user] making a chemical database ramakaalia
  • Re: [Cdk-user] making a chemical database Stefan Kuhn
• [Cdk-user] installation stanley5101
  • Re: [Cdk-user] installation Rajarshi Guha
• [Cdk-user] MCS indices mapping Tiqing Liu
• [Cdk-user] CML question Mark Rijnbeek
  • Re: [Cdk-user] CML question Egon Willighagen
  • Re: [Cdk-user] CML question Angel Herráez
• [Cdk-user] SMARTS & SMILES remy d1
  • Re: [Cdk-user] SMARTS & SMILES Rajarshi Guha
  • Re: [Cdk-user] SMARTS & SMILES Egon Willighagen
  • Re: [Cdk-user] SMARTS & SMILES Rajarshi Guha
  • Re: [Cdk-user] SMARTS & SMILES Egon Willighagen
• [Cdk-user] Google Wave Invite: but you need to work on the CDK and the CDKitty robot Egon Willighagen
• [Cdk-user] Fwd: [InChI-discuss] Aromatic molecules Egon Willighagen
  • Re: [Cdk-user] Fwd: [InChI-discuss] Aromatic molecules Vincent Le Guilloux
• [Cdk-user] [JCP applet]Smiles and aromaticity remy d1
  • Re: [Cdk-user] [JCP applet]Smiles and aromaticity Stefan Kuhn
  • Re: [Cdk-user] [JCP applet]Smiles and aromaticity Egon Willighagen
• [Cdk-user] Build CDK in NetBeans Andrzej Okuniewski
  • Re: [Cdk-user] Build CDK in NetBeans Vincent Le Guilloux
• [Cdk-user] New release of Cinfony with CDK 1.2.3 Noel O'Boyle
• [Cdk-user] Fwd: Re: Get image from JCP applet Stefan Kuhn
• [Cdk-user] you've got wild ideas? enter them on this forum Egon Willighagen
• [Cdk-user] re garding smarts searching performance sapana
  • Re: [Cdk-user] re garding smarts searching performance Rajarshi Guha
• [Cdk-user] problem related to smarts searching performance?? suyog
  • Re: [Cdk-user] problem related to smarts searching performance?? Rajarshi Guha
• [Cdk-user] Get image from JCP applet remy d1
  • Re: [Cdk-user] Get image from JCP applet Stefan Kuhn
  • Re: [Cdk-user] Get image from JCP applet remy d1
  • Re: [Cdk-user] Get image from JCP applet Angel Herráez
  • Re: [Cdk-user] Get image from JCP applet remy d1
  • Re: [Cdk-user] Get image from JCP applet Stefan Kuhn
  • Re: [Cdk-user] Get image from JCP applet remy d1
  • Re: [Cdk-user] Get image from JCP applet remy d1
  • Re: [Cdk-user] Get image from JCP applet remy d1
• Re: [Cdk-user] CDK 20060714 released suyog
• [Cdk-user] JCP applet editor options remy d1
  • Re: [Cdk-user] JCP applet editor options Stefan Kuhn
  • Re: [Cdk-user] JCP applet editor options remy d1
  • Re: [Cdk-user] JCP applet editor options Stefan Kuhn
  • Re: [Cdk-user] JCP applet editor options remy d1
  • Re: [Cdk-user] JCP applet editor options Stefan Kuhn
  • Re: [Cdk-user] JCP applet editor options remy d1
  • Re: [Cdk-user] JCP applet editor options Stefan Kuhn
  • Re: [Cdk-user] JCP applet editor options remy d1
  • Re: [Cdk-user] JCP applet editor options remy d1
• [Cdk-user] Question about Renderer2DModel.setBackColor and Renderer2DModel fonts Scooter Morris
  • Re: [Cdk-user] Question about Renderer2DModel.setBackColor and Renderer2DModel fonts Egon Willighagen
• [Cdk-user] SMARTSParser.jjt error Syed Asad Rahman
  • Re: [Cdk-user] SMARTSParser.jjt error Egon Willighagen
  • Re: [Cdk-user] SMARTSParser.jjt error Rajarshi Guha
  • Re: [Cdk-user] SMARTSParser.jjt error Syed Asad Rahman
  • Re: [Cdk-user] SMARTSParser.jjt error Rajarshi Guha
• Re: [Cdk-user] CDK bonds rendering Egon Willighagen
• [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Tobias Girschick
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Tobias Girschick
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Nina Jeliazkova
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Tobias Girschick
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Nina Jeliazkova
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Egon Willighagen
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Nina Jeliazkova
  • Re: [Cdk-user] Problem with org.openscience.cdk.qsar.DescriptorEngine and Java WebStart Rajarshi Guha
• [Cdk-user] Problem reading SDF Tobias Girschick
• [Cdk-user] Removing explicit hydrogens Thorsten Meinl
  • Re: [Cdk-user] Removing explicit hydrogens Egon Willighagen
• [Cdk-user] Anyone in Frankfurt on Monday Afternoon? Egon Willighagen
• Re: [Cdk-user] [Cdk-devel] Valence Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Valence Stefan Kuhn
  • Re: [Cdk-user] [Cdk-devel] Valence Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Valence Stefan Kuhn
• [Cdk-user] properties in an SD file? Rajarshi Guha
  • Re: [Cdk-user] properties in an SD file? Egon Willighagen
• [Cdk-user] String into java.io.InputStream David Hall
  • Re: [Cdk-user] String into java.io.InputStream gilleain torrance
• [Cdk-user] calculating all possible bond distances between the two Functional Groups??? suyog
  • Re: [Cdk-user] calculating all possible bond distances between the two Functional Groups??? Rajarshi Guha
  • Re: [Cdk-user] calculating all possible bond distances between the two Functional Groups??? suyog
• [Cdk-user] CDK API not available online??? suyog
  • Re: [Cdk-user] CDK API not available online??? Egon Willighagen
  • Re: [Cdk-user] CDK API not available online??? suyog
  • Re: [Cdk-user] CDK API not available online??? Rajarshi Guha
  • Re: [Cdk-user] CDK API not available online??? suyog
  • Re: [Cdk-user] CDK API not available online??? Egon Willighagen
• [Cdk-user] SMARTS search with fingerprints nlskrg
  • Re: [Cdk-user] SMARTS search with fingerprints Rajarshi Guha
• [Cdk-user] New development cycle: 1.3.x Egon Willighagen
• [Cdk-user] Writing sd-file for RingSet Peter Maas
  • Re: [Cdk-user] Writing sd-file for RingSet Egon Willighagen
• [Cdk-user] SMARTS matching and aromaticity detection Loren Lenzen
• [Cdk-user] Fwd: [Cdk-jchempaint] Two questions on class changes Egon Willighagen
• [Cdk-user] Changes in default cdk fingerprint Noel O'Boyle
  • Re: [Cdk-user] Changes in default cdk fingerprint Christoph Steinbeck
  • Re: [Cdk-user] Changes in default cdk fingerprint Egon Willighagen
  • Re: [Cdk-user] Changes in default cdk fingerprint Egon Willighagen
  • Re: [Cdk-user] Changes in default cdk fingerprint Noel O'Boyle
  • Re: [Cdk-user] Changes in default cdk fingerprint Egon Willighagen
  • Re: [Cdk-user] Changes in default cdk fingerprint Stefan Kuhn
  • Re: [Cdk-user] Changes in default cdk fingerprint Egon Willighagen
• [Cdk-user] nice tool employing CDK Rajarshi Guha
  • Re: [Cdk-user] nice tool employing CDK Noel O'Boyle
  • Re: [Cdk-user] nice tool employing CDK Egon Willighagen
  • Re: [Cdk-user] nice tool employing CDK Egon Willighagen
  • Re: [Cdk-user] nice tool employing CDK Rajarshi Guha
  • Re: [Cdk-user] nice tool employing CDK Egon Willighagen
  • Re: [Cdk-user] nice tool employing CDK gilleain torrance
  • Re: [Cdk-user] nice tool employing CDK Rajarshi Guha
  • Re: [Cdk-user] nice tool employing CDK Egon Willighagen
  • Re: [Cdk-user] nice tool employing CDK Egon Willighagen
• [Cdk-user] Using PDBReader to access a ligand in a PDB file Pablo Moreno
• [Cdk-user] Avoiding cofactors when loading molecules from sdf file Thomas Greve Kristensen
• [Cdk-user] How identify douplicate molecules??? suyog
  • Re: [Cdk-user] How identify douplicate molecules??? gilleain torrance
  • Re: [Cdk-user] How identify douplicate molecules??? Xin Gong
  • Re: [Cdk-user] How identify douplicate molecules??? Rajarshi Guha
  • Re: [Cdk-user] How identify douplicate molecules??? Christoph Steinbeck
• [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile Egon Willighagen
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile Egon Willighagen
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
  • Re: [Cdk-user] Descriptor Values differences from SMILES and from MDL molfile sebi
• [Cdk-user] jchempaint-primary sebi
  • Re: [Cdk-user] jchempaint-primary Egon Willighagen
• [Cdk-user] Making patch; Attribution; Copyright and License. Egon Willighagen
• [Cdk-user] CDK equivalents for MOE SMARTS expressions? Egon Willighagen
  • Re: [Cdk-user] CDK equivalents for MOE SMARTS expressions? Sam Adams
  • Re: [Cdk-user] CDK equivalents for MOE SMARTS expressions? Egon Willighagen
  • Re: [Cdk-user] CDK equivalents for MOE SMARTS expressions? Sam Adams
• [Cdk-user] Hosting CDK on Google App Engine charlie zhu
  • Re: [Cdk-user] Hosting CDK on Google App Engine Duan Lian
  • Re: [Cdk-user] Hosting CDK on Google App Engine Duan Lian
  • Re: [Cdk-user] Hosting CDK on Google App Engine Christoph Steinbeck
  • Re: [Cdk-user] Hosting CDK on Google App Engine Dieter Krachtus
  • Re: [Cdk-user] Hosting CDK on Google App Engine Rajarshi Guha
  • Re: [Cdk-user] Hosting CDK on Google App Engine charlie zhu
• [Cdk-user] cdk/rcdk alogp question Xin Gong
  • Re: [Cdk-user] cdk/rcdk alogp question Egon Willighagen
  • Re: [Cdk-user] cdk/rcdk alogp question Xin Gong
• [Cdk-user] CDK descriptors Explicte Hydrogens as parameter? Peter Maas
• [Cdk-user] thread-safety and DefaultChemObjectBuilder Egon Willighagen
• [Cdk-user] SMARTS Parser [email protected]
  • Re: [Cdk-user] SMARTS Parser Egon Willighagen
  • Re: [Cdk-user] SMARTS Parser Rajarshi Guha
• [Cdk-user] CSV to SDF conversion Om
  • Re: [Cdk-user] CSV to SDF conversion Egon Willighagen
  • Re: [Cdk-user] CSV to SDF conversion Om
• [Cdk-user] problem calculating xLogP 陈世林
• [Cdk-user] Remove all of a molecule's ChemObjectListeners Pudney Chris GBJH
  • Re: [Cdk-user] Remove all of a molecule's ChemObjectListeners Egon Willighagen
• [Cdk-user] Problem while get Molecular Formula 陈世林
  • Re: [Cdk-user] Problem while get Molecular Formula Egon Willighagen
• [Cdk-user] The CDK 'Don't use this Renderer' 1.2.3 release Egon Willighagen
• [Cdk-user] Fwd: SourceForge Community Choice Awards Nominations Egon Willighagen
• [Cdk-user] Problem using Java2DRenderer sebi

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