Chair and Department of Organic Chemistry
Quantum, semi-empirical, and molecular dynamics calculations of biologically active compounds in their chemical environment; the use of Python for result analysis, machine learning, and deep learning; RNN and CNN neural networks; transfer learning in drug design; digital analysis of medical images.
quantum-mechanics, semiempirical calculations, molecular dynamics, NMR, Gaussian, Molpac, Gromacs, python, machine learning, transfer learning, CNN, RNN, LLM, agentic AI, computer vision
✉ jacekkuj ( AT ) ump.edu.pl
