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• • Re: [Cdk-user] [Cdk-devel] can't build latest bundle JAR Nina Jeliazkova
  • Re: [Cdk-user] [Cdk-devel] can't build latest bundle JAR John May
  • Re: [Cdk-user] can't build latest bundle JAR Rajarshi Guha
• Re: [Cdk-user] aromaticity perception with cdk John May
  • Re: [Cdk-user] aromaticity perception with cdk John May
• [Cdk-user] questions about bond types and representation for benzene in cdk Zheng Shi
  • Re: [Cdk-user] questions about bond types and representation for benzene in cdk John May
  • Re: [Cdk-user] questions about bond types and representation for benzene in cdk Yannick .Djoumbou
  • Re: [Cdk-user] questions about bond types and representation for benzene in cdk John May
• [Cdk-user] Get associated information from SDF file with CDK Zheng Shi
  • Re: [Cdk-user] Get associated information from SDF file with CDK Egon Willighagen
  • Re: [Cdk-user] Get associated information from SDF file with CDK John May
  • Re: [Cdk-user] Get associated information from SDF file with CDK John May
• [Cdk-user] Release 1.5.7 John May
  • Re: [Cdk-user] [Cdk-devel] Release 1.5.7 Rajarshi Guha
  • Re: [Cdk-user] Release 1.5.7 Christoph Steinbeck
• [Cdk-user] Is there any way to filter out peptides from a sdf file? 杜宇
  • Re: [Cdk-user] Is there any way to filter out peptides from a sdf file? 杜宇
  • Re: [Cdk-user] Is there any way to filter out peptides from a sdf file? Christoph Steinbeck
  • Re: [Cdk-user] Is there any way to filter out peptides from a sdf file? 杜宇
• [Cdk-user] Winners of the Teach-Discover-Treat 2014 Challenge Emilio Xavier Esposito
• [Cdk-user] Stereo Chem Syed Asad Rahman
  • Re: [Cdk-user] Stereo Chem John May
  • Re: [Cdk-user] Stereo Chem Syed Asad Rahman
  • Re: [Cdk-user] Stereo Chem John May
  • Re: [Cdk-user] Stereo Chem John May
• Re: [Cdk-user] Cdk 1.6 John May
• [Cdk-user] CDK 1.5.6 Released John May
• [Cdk-user] FixBondOrdersTool in molecules (SDF/Mol) with aromatic rings and formal charges defined Oscar Mora
  • Re: [Cdk-user] FixBondOrdersTool in molecules (SDF/Mol) with aromatic rings and formal charges defined John May
  • Re: [Cdk-user] FixBondOrdersTool in molecules (SDF/Mol) with aromatic rings and formal charges defined Oscar Mora
  • Re: [Cdk-user] FixBondOrdersTool in molecules (SDF/Mol) with aromatic rings and formal charges defined John May
• [Cdk-user] cdk 1.4.19 SDFWriter with StringWriter lochana menikarachchi
  • Re: [Cdk-user] cdk 1.4.19 SDFWriter with StringWriter John May
• [Cdk-user] ECFP/FCFP circular fingerprints in CDK Martin Guetlein
  • Re: [Cdk-user] ECFP/FCFP circular fingerprints in CDK Egon Willighagen
  • Re: [Cdk-user] ECFP/FCFP circular fingerprints in CDK Martin Guetlein
  • Re: [Cdk-user] ECFP/FCFP circular fingerprints in CDK John May
  • Re: [Cdk-user] ECFP/FCFP circular fingerprints in CDK Martin Guetlein
  • Re: [Cdk-user] ECFP/FCFP circular fingerprints in CDK Egon Willighagen
• [Cdk-user] Using the CDK from Scala John May
• [Cdk-user] CDK cmd line utilities (was: About the detection of identical entries) Egon Willighagen
  • Re: [Cdk-user] CDK cmd line utilities (was: About the detection of identical entries) John May
• [Cdk-user] CDK License lochana menikarachchi
  • Re: [Cdk-user] CDK License Egon Willighagen
  • Re: [Cdk-user] CDK License John May
  • Re: [Cdk-user] CDK License lochana menikarachchi
  • Re: [Cdk-user] CDK License David Hall
• [Cdk-user] Atom Atom Mapping Tool Syed Asad Rahman
• [Cdk-user] Distance Calculation between two atoms Vaibhav
  • Re: [Cdk-user] Distance Calculation between two atoms Egon Willighagen
  • Re: [Cdk-user] Distance Calculation between two atoms Rajarshi Guha
• [Cdk-user] IteratingSMILESReader and kekulise option Rajarshi Guha
  • Re: [Cdk-user] IteratingSMILESReader and kekulise option John May
• [Cdk-user] including cdk in another project Rajarshi Guha
  • Re: [Cdk-user] including cdk in another project John May
  • Re: [Cdk-user] including cdk in another project Rajarshi Guha
  • Re: [Cdk-user] including cdk in another project John May
  • Re: [Cdk-user] including cdk in another project Rajarshi Guha
  • Re: [Cdk-user] including cdk in another project John May
  • Re: [Cdk-user] including cdk in another project Rajarshi Guha
  • Re: [Cdk-user] including cdk in another project Rajarshi Guha
  • Re: [Cdk-user] including cdk in another project Joos Kiener
  • Re: [Cdk-user] including cdk in another project John May
• [Cdk-user] how to solve this compile error: "Plugin requires Maven version 3.0" Egon Willighagen
  • Re: [Cdk-user] how to solve this compile error: "Plugin requires Maven version 3.0" Nina Jeliazkova
  • Re: [Cdk-user] how to solve this compile error: "Plugin requires Maven version 3.0" John May
  • Re: [Cdk-user] how to solve this compile error: "Plugin requires Maven version 3.0" Nina Jeliazkova
• [Cdk-user] ScaffoldHunter and NRNB are in the Google Summer of Code 2014 Egon Willighagen
• [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order John May
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order John May
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order John May
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order John May
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order John May
  • Re: [Cdk-user] [Urgent] Questions regarding CDK, structure search, and bond order Yannick .Djoumbou
• [Cdk-user] Maven Build of the CDK John May
• [Cdk-user] aromaticity rendering issue Rajarshi Guha
  • Re: [Cdk-user] aromaticity rendering issue John May
  • Re: [Cdk-user] aromaticity rendering issue Rajarshi Guha
  • Re: [Cdk-user] aromaticity rendering issue John May
  • Re: [Cdk-user] aromaticity rendering issue Rajarshi Guha
• [Cdk-user] display molecule with charge Rajarshi Guha
  • Re: [Cdk-user] display molecule with charge John May
  • Re: [Cdk-user] display molecule with charge John May
  • Re: [Cdk-user] display molecule with charge Rajarshi Guha
  • Re: [Cdk-user] display molecule with charge John May
  • Re: [Cdk-user] display molecule with charge Rajarshi Guha
• [Cdk-user] MCS question Rajarshi Guha
  • Re: [Cdk-user] MCS question John May
  • Re: [Cdk-user] MCS question Rajarshi Guha
  • Re: [Cdk-user] MCS question John May
  • Re: [Cdk-user] MCS question Rajarshi Guha
  • Re: [Cdk-user] MCS question John May
• [Cdk-user] how to build cdk master Rajarshi Guha
  • Re: [Cdk-user] how to build cdk master John May
  • Re: [Cdk-user] how to build cdk master John May
  • Re: [Cdk-user] how to build cdk master Rajarshi Guha
• [Cdk-user] cdk ebi maven repository lochana menikarachchi
  • Re: [Cdk-user] cdk ebi maven repository John May
  • Re: [Cdk-user] cdk ebi maven repository John May
• [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder Nick Vandewiele
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder Nick Vandewiele
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder Nick Vandewiele
  • Re: [Cdk-user] SMARTS matching after implicit to explict hydrogen conversion and SSSRing finder John May
• [Cdk-user] parse custom symbols with SMILESParser in CDK 1.5.4? Nick Vandewiele
  • Re: [Cdk-user] parse custom symbols with SMILESParser in CDK 1.5.4? John May
• [Cdk-user] Regarding simple DescriptorEngine() program Anurag Passi
  • Re: [Cdk-user] Regarding simple DescriptorEngine() program John May
  • Re: [Cdk-user] Regarding simple DescriptorEngine() program Anurag Passi
• [Cdk-user] CDK Development Release 1.5.5 John May
• [Cdk-user] in memoriam: Patrik Rydberg Egon Willighagen
• [Cdk-user] Substructure matching lochana menikarachchi
• [Cdk-user] Still time to participate in the Teach-Discover-Treat 2014 Competition! Emilio Xavier Esposito
• [Cdk-user] JChemPaint-HotFix John May
• [Cdk-user] compound neutralization Yingfeng Wang
  • Re: [Cdk-user] compound neutralization John May
  • Re: [Cdk-user] compound neutralization Yingfeng Wang
  • Re: [Cdk-user] [Cdk-devel] compound neutralization John May
• [Cdk-user] CDK Development Release 1.5.4 John May
  • Re: [Cdk-user] [Cdk-devel] CDK Development Release 1.5.4 Nina Jeliazkova
  • Re: [Cdk-user] [Cdk-devel] CDK Development Release 1.5.4 Christoph Steinbeck
  • Re: [Cdk-user] [Cdk-devel] CDK Development Release 1.5.4 Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] CDK Development Release 1.5.4 Syed Asad Rahman
• [Cdk-user] Announcement: ChemicalToolBox bjoern.gruen...@googlemail.com
  • Re: [Cdk-user] Announcement: ChemicalToolBox Egon Willighagen
• [Cdk-user] THX for new isomeric SMILES parser Till Schäfer
  • Re: [Cdk-user] THX for new isomeric SMILES parser John May
  • Re: [Cdk-user] THX for new isomeric SMILES parser Till Schäfer
  • Re: [Cdk-user] THX for new isomeric SMILES parser John May
• [Cdk-user] Inchi to structure Christophe Marcourt
  • Re: [Cdk-user] Inchi to structure John May
  • Re: [Cdk-user] Inchi to structure Christophe Marcourt
  • Re: [Cdk-user] Inchi to structure John May
  • Re: [Cdk-user] Inchi to structure Christophe Marcourt
  • Re: [Cdk-user] Inchi to structure Christophe Marcourt
  • Re: [Cdk-user] Inchi to structure John May
  • Re: [Cdk-user] Inchi to structure Christophe Marcourt
  • Re: [Cdk-user] [Cdk-devel] Inchi to structure Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Inchi to structure Christophe Marcourt
• [Cdk-user] SMILES parsing error Rajarshi Guha
  • Re: [Cdk-user] SMILES parsing error Nina Jeliazkova
  • Re: [Cdk-user] SMILES parsing error Nina Jeliazkova
  • Re: [Cdk-user] SMILES parsing error John May
  • Re: [Cdk-user] SMILES parsing error Rajarshi Guha
  • Re: [Cdk-user] SMILES parsing error John May
• [Cdk-user] AtomContainer - Poll Results John May
  • Re: [Cdk-user] [Cdk-devel] AtomContainer - Poll Results Egon Willighagen
• [Cdk-user] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Nina Jeliazkova
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Nina Jeliazkova
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Christoph Steinbeck
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Nina Jeliazkova
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Egon Willighagen
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming Rajarshi Guha
  • Re: [Cdk-user] Important: Your vote needed on some API re-naming Joos Kiener
  • Re: [Cdk-user] [Cdk-devel] Important: Your vote needed on some API re-naming John May
• [Cdk-user] circular fingerprints Rajarshi Guha
  • Re: [Cdk-user] circular fingerprints Jonathan Alvarsson
  • Re: [Cdk-user] circular fingerprints Rajarshi Guha
  • Re: [Cdk-user] circular fingerprints John May
  • Re: [Cdk-user] circular fingerprints Nina Jeliazkova
• [Cdk-user] Storing IAtomContainers in a Database lochana menikarachchi
  • Re: [Cdk-user] Storing IAtomContainers in a Database Egon Willighagen

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