Comparison of descriptor-and fingerprint sets in machine learning models for ADME-Tox targets Á Orosz, K Héberger, A Rácz Frontiers in Chemistry 10, 852893, 2022 | 26 | 2022 |
Population Balance Modeling of Diastereomeric Salt Resolution MH Bosits, A Orosz, Z Szalay, H Pataki, B Szilágyi, Á Demeter Crystal Growth & Design, 2023 | 3 | 2023 |
Diastereomer salt crystallization: Comprehensive process modeling and DoE-driven comparison of custom-coded and user-friendly simulators Á Orosz, MH Bosits, É Pusztai, H Pataki, Z Szalay, Á Demeter, B Szilágyi Chemical Engineering Journal 473, 145257, 2023 | 1 | 2023 |
Dynamic Modeling and Optimal Design Space Determination of Pharmaceutical Crystallization Processes: Realizing the Synergy between Off-the-Shelf Laboratory and Industrial Scale … A Orosz, E Szilágyi, A Spaits, A Borsos, F Farkas, I Markovits, L Százdi, ... Industrial & Engineering Chemistry Research, 2024 | | 2024 |
PyPINNChem: an Open-source Tool for Chemical Reaction Modeling Using Physics-informed Neural Networks M Susits, Á Orosz, B Szilagyi Elsevier, Forthcoming, 2023 | | 2023 |