Articles Tagged "cdk"


Porting MX: CDK-Compatible VF Implementation
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Friday June 26, 2009

MX Performance Comparison #3: Substructure Search in MX and CDK
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Thursday January 22, 2009

MX Performance Comparison #2: Exhaustive Ring Perception in MX and CDK
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Wednesday January 21, 2009

Open Benchmarks for Cheminformatics: First Performance Comparison Between CDK and MX
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Tuesday January 20, 2009

Open Benchmarks for Cheminformatics: Working with Japex
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Wednesday January 14, 2009

Choose Java for Speed
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Thursday December 04, 2008

CampDepict: Building a Simple SMILES Depict Web Application With JRuby, Structure CDK, and Camping
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Wednesday April 23, 2008

Five Open Tools for 2D Structure Layout (aka Structure Diagram Generation)
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Wednesday March 26, 2008

Simple Installation of Rubidium
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Wednesday November 21, 2007

An Introduction to the Rubidium Cheminforamtics Toolkit: Interconvert SMILES, InChI, and Molfile with an Open Babel-Like Interface
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Monday October 15, 2007

JRuby for Cheminformatics: Reading and Writing InChIs Via the Java Native Interface
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Wednesday October 10, 2007

JRuby for Cheminformatics: Parsing SMILES Simply
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Tuesday October 09, 2007

Roll Your Own Chemical Database With Free Components
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Friday April 13, 2007

Making the Case: Flux-2
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Monday February 26, 2007

Making the Case: Personal Chemistry Client
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Friday January 19, 2007

Diversity-Oriented Chemical Informatics
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Wednesday November 15, 2006

Agile Chemical Informatics Development with CDK and Ruby: RCDK-0.3.0
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Monday October 30, 2006

Making the Case: Milestones in Bio- and Chem(o)informatics
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Tuesday October 24, 2006

From IUPAC Nomenclature to 2-D Structures With OPSIN
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Tuesday October 17, 2006

CDK, the Ruby Way: RCDK-0.2.0
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Monday September 25, 2006

CDK, the Ruby Way
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Thursday September 14, 2006

Drawing 2-D Structures with Structure-CDK
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Monday August 28, 2006

Scripting CDK with JRuby
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Thursday August 24, 2006