First US–Macedonian Workshop on Modeling in Chemistry and Biochemistry

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A Quantum Mechanical Approach to Correlate the Chemical Reactivity Descriptors with Catalytic Reactivity

Applying Machine Learning Techniques to Evaluate DNA-Reactive Properties of Generic Drug Impurities

Atomic charges and molecular electrostatic potential in drug design: refined empirical approaches

Chirobiophore: A new paradigm for the multidimensional characterization of chirality of complex biological macromolecular systems

Digital Chemistry as an Interplay of Chemistry, Mathematics and Informatics

Higher Dimensional Structures for Better Understanding of the Chemical Space and Its Evolution

Integrative Machine Learning and Structural Dynamics Approaches to Decipher Phenotypic Outcomes of Oncoprotein Missense Mutations in Cancer and Neurodevelopmental Disorders

Laplacian Matrix Descriptors Based on Atomic Properties

Mediation of Electron Transfer by Quadrupolar Interactions: A Characterization of Covalency within van der Waals Distance Limit

Modelling the dynamics of molecular clusters with atom-centered density matrix propagation techniques, coupled with time series analysis and two-dimensional correlation approaches

Opening ceremony

The utility of the four pillars of mathematical chemistry & QSAR in the service of the seven pillars of life: A novel perspective

‘Small and big' in computational modelling of toxicological endpoints

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14/10/2025

15/10/2025

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