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Publications by Matthias Rarey

Systematic Benchmark of Substructure Search in Molecular Graphs - From Ullmann to VF2

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2012English

Let's Talk About Rings

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2013English

Exploring Structure-Activity Relationships With Three-Dimensional Matched Molecular Pairs - A Review

ChemMedChem
Organic ChemistryMolecular MedicinePharmacologyBiochemistryToxicologyDrug DiscoveryPharmaceutics
2018English

Computational Macrocyclization: From De Novo Macrocycle Generation to Binding Affinity Estimation

ChemMedChem
Organic ChemistryMolecular MedicinePharmacologyBiochemistryToxicologyDrug DiscoveryPharmaceutics
2017English

What Is the Potential of Structure-Based Target Prediction Methods?

Future Medicinal Chemistry
Drug DiscoveryMolecular MedicinePharmacology
2014English

Corrigendum: The Art of Compiling Protein Binding Site Ensembles

Molecular Informatics
Organic ChemistryDrug DiscoveryComputer Science ApplicationsMolecular MedicineStructural Biology
2017English

A Fast Flexible Docking Method Using an Incremental Construction Algorithm

Journal of Molecular Biology
Structural BiologyMolecular BiologyBiophysics
1996English

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