Author

J. Korábečný

2 papers indexed here

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Open access Sep 2026

Why choose between prediction power and mechanistic insight in QSRR modeling? A case study of artificial membrane chromatography and machine learning.

Quantitative structure-retention relationship (QSRR) modeling of immobilized artificial membrane (IAM) chromatography was performed on a chemically diverse set of 2003 analytes to determine whether mechanistically interpretable, descriptor-based models can match the predictive performance of advanced machine-learning a...

W. Nisterenko, Julia Nicman, Jiayin Deng et al. · Analytica Chimica Acta · 0 citations

Sep 2026

Exploring the structural requirements of fluorinated benzylidene-thiazolidinediones for selective antitrypanosomal activity.

Human and animal African trypanosomiasis remain serious parasitic diseases requiring the development of new therapeutics with improved efficacy and safety profiles. In this study, a series of novel heterocyclic derivatives based on previously identified thiazolidinedione scaffolds were designed, synthesized, and evalua...

Michal Kolařík, N. Santarém, A. Cordeiro-da-Silva et al. · European journal of medicina... · 0 citations