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ORCIDJaroslaw J. Panek
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Journal Articles
- 2023
[j13]Katarzyna M. Krupka
, Sylwia Banach, Michal Pochec, Jaroslaw J. Panek, Aneta Jezierska:
Making and Breaking - Insight into the Symmetry of Salen Analogues. Symmetry 15(2): 424 (2023)- 2022
- [j12]Kamil Wojtkowiak, Aneta Jezierska, Jaroslaw J. Panek:
Interactions between Artificial Channel Protein, Water Molecules, and Ions Based on Theoretical Approaches. Symmetry 14(4): 691 (2022) - 2021
- [j11]Beata Kizior, Jaroslaw J. Panek, Bartlomiej M. Szyja, Aneta Jezierska:
Structure-Property Relationship in Selected Naphtho- and Anthra-Quinone Derivatives on the Basis of Density Functional Theory and Car-Parrinello Molecular Dynamics. Symmetry 13(4): 564 (2021) - 2020
- [j10]Beata Kizior, Jaroslaw J. Panek, Aneta Jezierska:
Microsolvation of Histidine - A Theoretical Study of Intermolecular Interactions Based on AIM and SAPT Approaches. Symmetry 12(7): 1153 (2020) - [j9]Patrycja Piekos, Aneta Jezierska, Jaroslaw J. Panek, Eugene A. Goremychkin, Alexander F. Pozharskii, Alexander S. Antonov, Peter M. Tolstoy, Aleksander Filarowski:
Symmetry/Asymmetry of the NHN Hydrogen Bond in Protonated 1, 8-Bis(dimethylamino)naphthalene. Symmetry 12(11): 1924 (2020) - 2015
- [j8]Aneta Jezierska, Jaroslaw J. Panek:
"Zwitterionic Proton Sponge" Hydrogen Bonding Investigations on the Basis of Car-Parrinello Molecular Dynamics. J. Chem. Inf. Model. 55(6): 1148-1157 (2015) - 2014
- [j7]Jaroslaw J. Panek, Aneta Jezierska-Mazzarello, Pawel Lipkowski, Agata Martyniak, Aleksander Filarowski:
Comparison of Resonance Assisted and Charge Assisted Effects in Strengthening of Hydrogen Bonds in Dipyrrins. J. Chem. Inf. Model. 54(1): 86-95 (2014) - 2012
- [j6]Agata Martyniak, Jaroslaw J. Panek, Aneta Jezierska-Mazzarello, Aleksander Filarowski:
Triple hydrogen bonding in a circular arrangement: ab initio, DFT and first-principles MD studies of tris-hydroxyaryl enamines. J. Comput. Aided Mol. Des. 26(9): 1045-1053 (2012) - 2010
- [j5]Jaroslaw J. Panek, Thomas R. Ward, Aneta Jezierska-Mazzarello, Marjana Novic:
Flexibility of a biotinylated ligand in artificial metalloenzymes based on streptavidin - an insight from molecular dynamics simulations with classical and ab initio force fields. J. Comput. Aided Mol. Des. 24(9): 719-732 (2010) - 2009
- [j4]Aneta Jezierska, Jaroslaw J. Panek:
Investigations of an O-H * * * S hydrogen bond via Car-Parrinello and path integral molecular dynamics. J. Comput. Chem. 30(8): 1241-1250 (2009) - 2007
- [j3]Aneta Jezierska, Jaroslaw J. Panek, Aleksander Filarowski:
Molecular Properties Investigation of a Substituted Aromatic Mannich Base: Dynamic and Static Models. J. Chem. Inf. Model. 47(3): 818-831 (2007) - 2005
- [j2]Jaroslaw J. Panek, Aneta Jezierska, Krzysztof Mierzwicki, Zdzislaw Latajka, Aleksander Koll:
Molecular Modeling Study of Leflunomide and Its Active Metabolite Analogues. J. Chem. Inf. Model. 45(1): 39-48 (2005) - [j1]Jaroslaw J. Panek, Aneta Jezierska, Marjan Vracko:
Kohonen Network Study of Aromatic Compounds Based on Electronic and Nonelectronic Structure Descriptors. J. Chem. Inf. Model. 45(2): 264-272 (2005)
Coauthor Index
aka: Aneta Jezierska
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