Novel sterically demanding Schiff base dyes: An insight from experimental and theoretical calculations DA Safin, MG Babashkina, M Bolte, AL Ptaszek, M Kukułka, MP Mitoraj Journal of Luminescence 238, 118264, 2021 | 15 | 2021 |
Origin of Hydrocarbons Stability from a Computational Perspective: A Case Study of Ortho‐Xylene Isomers MP Mitoraj, F Sagan, DW Szczepanik, JH de Lange, AL Ptaszek, ... ChemPhysChem 21 (6), 494-502, 2020 | 15 | 2020 |
Solvent-Induced Formation of Novel Ni (II) Complexes Derived from Bis-Thiosemicarbazone Ligand: An Insight from Experimental and Theoretical Investigations G Mahmoudi, MG Babashkina, W Maniukiewicz, FA Afkhami, BB Nunna, ... International journal of molecular sciences 22 (10), 5337, 2021 | 8 | 2021 |
Harnessing PROTAC technology to combat stress hormone receptor activation M Gazorpak, KM Hugentobler, D Paul, PL Germain, M Kretschmer, ... Nature Communications 14 (1), 8177, 2023 | 1 | 2023 |
Highly Accurate Prediction of NMR Chemical Shifts from Low-Level Quantum Mechanics Calculations Using Machine Learning J Li, J Liang, Z Wang, AL Ptaszek, X Liu, B Ganoe, M Head-Gordon, ... Journal of Chemical Theory and Computation, 2024 | | 2024 |
Cover Feature: Ligand 1H NMR Chemical Shifts as Accurate Reporters for Protein‐Ligand Binding Interfaces in Solution (ChemPhysChem 1/2024) G Platzer, AL Ptaszek, J Böttcher, JE Fuchs, L Geist, D Braun, ... ChemPhysChem 25 (1), e202300920, 2024 | | 2024 |
Ligand 1H NMR Chemical Shifts as Accurate Reporters for Protein‐Ligand Binding Interfaces in Solution** G Platzer, AL Ptaszek, J Böttcher, JE Fuchs, L Geist, D Braun, ... ChemPhysChem 25 (1), e202300636, 2024 | | 2024 |
Correction: Solvent-Induced Formation of Novel Ni (II) Complexes Derived from Bis-Thiosemicarbazone Ligand: An Insight from Experimental and Theoretical Investigations (Int. J … G Mahmoudi, MG Babashkina, W Maniukiewicz, FA Afkhami, BB Nunna, ... MDPI 23 (21), 2022 | | 2022 |
Theoretical description of hydride-hydride interactions in selected hydrogen storage materials A Ptaszek | | 2021 |
Steryczna i elektrostatyczna stabilizacja w nietypowych układach opartych na berylu (0)-badania teoretyczne z wykorzystaniem teorii funkcjonałów gęstości elektronowej (DFT) A Ptaszek | | 2020 |
Cover Feature: Origin of Hydrocarbons Stability from a Computational Perspective: A Case Study of Ortho‐Xylene Isomers (ChemPhysChem 6/2020) MP Mitoraj, F Sagan, DW Szczepanik, JH de Lange, AL Ptaszek, ... ChemPhysChem 21 (6), 467-467, 2020 | | 2020 |