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Iucrj|October 17, 2025
Protein electrostatic potential Fourier maps calculated using the transferable aspherical atom model and the independent atom model across resolutionsMarta Kulik, Paulina Maria DominiakActa Crystallographica. Section D, Structural Biology|August 2, 2022
Theoretical 3D electron diffraction electrostatic potential maps of proteins modeled with a multipolar pseudoatom data bankMarta Kulik, Michał Leszek Chodkiewicz, Paulina Maria DominiakActa Crystallographica. Section A, Foundations and Advances|June 12, 2026
From atoms to a data bank: optimizing transferability of electron-density symmetryPaulina Maria Rybicka, Marta Kulik, Vladislav Ignat'ev, et al.Journal of Chemical Information and Modeling|August 9, 2022
Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Impact of Surrounding Atoms on Electron Density from Cluster AnalysisPaulina Maria Rybicka, Marta Kulik, Michał Leszek Chodkiewicz, et al.The Journal of Physical Chemistry. B|November 3, 2022
The Role of Electrostatic Interactions in IFIT5-RNA Complexes Predicted by the UBDB+EPMM MethodUrszula Anna Budniak, Natalia Katarzyna Karolak, Marta Kulik, et al.Molecules (Basel, Switzerland)|July 2, 2021
Combining Molecular Dynamic Information and an Aspherical-Atom Data Bank in the Evaluation of the Electrostatic Interaction Energy in Multimeric Protein-Ligand Complex: A Case Study for HIV-1 ProteasePrashant Kumar, Paulina Maria DominiakJournal of Applied Crystallography|September 11, 2025
Towards expansion of the MATTS data bank with heavier elements: the influence of the wavefunction basis set on the multipole model derived from the wavefunctionVladislav Ignat'ev, Paulina Maria DominiakNucleic Acids Research|July 30, 2020
Frequency and hydrogen bonding of nucleobase homopairs in small molecule crystalsMałgorzata Katarzyna Cabaj, Paulina Maria DominiakActa Crystallographica. Section C, Structural Chemistry|January 6, 2018
Molecular tapes in the structure of isoguaninium chlorideUrszula Anna Budniak, Paulina Maria DominiakActa Crystallographica. Section A, Foundations of Crystallography|October 19, 2012
Is it possible to derive quantitative information on polarization of electron density from the multipolar model?Joanna Maria Bąk, Zaneta Czyżnikowska, Paulina Maria DominiakPageof 5