Author

Katarzyna Mądra-Gackowska

3 papers indexed here

We haven’t gathered this author’s papers yet. Follow them and we’ll fetch their work.

Not the right person? Other researchers publish under this name.

Open access Aug 2026

Quantitative Structural Thresholds for Blood–Brain Barrier Permeability Derived from Experimental logBB Measurements

Background/Objectives: Rules for predicting blood–brain barrier (BBB) permeability, including the CNS multiparameter optimization (CNS MPO) score, Lipinski’s Rule of Five, and Veber’s rules, were developed using relatively limited datasets and have not been systematically re-evaluated using modern large-scale experimen...

S. Tiwari, Katarzyna Mądra-Gackowska, Marcin Gackowski et al. · Pharmaceutics · 0 citations

Open access Aug 2026

Evaluating the Incremental Value of Three-Dimensional Conformer Descriptors for Blood–Brain Barrier Permeability Prediction Using the B3DB Benchmark Dataset

Background/Objectives: Predicting blood–brain barrier (BBB) permeability remains a major challenge in central nervous system (CNS) drug discovery. Three-dimensional (3D) conformer-derived molecular descriptors are often proposed as improvements over conventional two-dimensional (2D) topological representations; however...

S. Tiwari, Katarzyna Mądra-Gackowska, Marcin Gackowski et al. · Pharmaceutics · 0 citations

Open access Aug 2026

Exploring the physical properties of ZnAgX3 (X = F, Cl, Br) for optoelectronic and thermoelectric applications: a DFT study

The growing demand for efficient energy conversion and advanced optoelectronic devices has driven extensive research into multifunctional materials with tunable physical properties. In this work, we present a comprehensive first-principles investigation of cubic perovskites ZnAgX3 (X = F, Cl, Br) using density function...

Ł. Szeleszczuk, Katarzyna Mądra-Gackowska, Marcin Gackowski · Physica Scripta · 0 citations