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Tag: cheminformatics

CDK – cheminformatics and bioinformatics toolkit

September 19, 2026 Steve Emms Scientific

CDK is a Java toolkit providing algorithms and data structures for cheminformatics, molecular processing and chemical informatics.

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Chemistry

Indigo – universal cheminformatics toolkit

May 4, 2026 Steve Emms Scientific

Indigo is a universal cheminformatics toolkit for working with molecules and reactions.

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