Can We Predict the Pressure Induced Phase Transition of Urea? Application of Quantum Molecular Dynamics

by Anna Mazurek, Łukasz Szeleszczuk, Dariusz Maciej Pisklak
Published 2020-03-01

Periodic DFT Calculations—Review of Applications in the Pharmaceutical Sciences

by Anna Helena Mazurek, Łukasz Szeleszczuk, Dariusz Maciej Pisklak
Published 2020-05-01

A Review on Combination of ab Initio Molecular Dynamics and NMR Parameters Calculations

by Anna Helena Mazurek, Łukasz Szeleszczuk, Dariusz Maciej Pisklak
Published 2021-04-01

Application of Various Molecular Modelling Methods in the Study of Estrogens and Xenoestrogens

by Anna Helena Mazurek, Łukasz Szeleszczuk, Thomas Simonson, Dariusz Maciej Pisklak
Published 2020-09-01

Can We Predict the Isosymmetric Phase Transition? Application of DFT Calculations to Study the Pressure Induced Transformation of Chlorothiazide

by Łukasz Szeleszczuk, Anna Helena Mazurek, Katarzyna Milcarz, Ewa Napiórkowska, Dariusz Maciej Pisklak
Published 2021-09-01

Pharmaceutical Hydrates Analysis—Overview of Methods and Recent Advances

by Ewa Jurczak, Anna Helena Mazurek, Łukasz Szeleszczuk, Dariusz Maciej Pisklak, Monika Zielińska-Pisklak
Published 2020-10-01