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November 19, 2020
Hirshfeld atom like refinement with alternative electron density partitions
Michał Leszek Chodkiewicz, Magdalena Woińska, Krzysztof Woźniak
Acta Crystallographica. Section D, Structural Biology
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August 2, 2022
Theoretical 3D electron diffraction electrostatic potential maps of proteins modeled with a multipolar pseudoatom data bank
Marta Kulik, Michał Leszek Chodkiewicz, Paulina Maria Dominiak
Acta Crystallographica. Section A, Foundations and Advances
|
January 8, 2020
Refinement of organic crystal structures with multipolar electron scattering factors
Barbara Gruza, Michał Leszek Chodkiewicz, Joanna Krzeszczakowska, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 4, 2016
An insight into real and average structure from diffuse X-ray scattering - a case study
Michał Leszek Chodkiewicz, Anna Makal, Roman Gajda, 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 Analysis
Paulina Maria Rybicka, Marta Kulik, Michał Leszek Chodkiewicz, et al.
Journal of Applied Crystallography
|
February 13, 2023
Aspherical atom refinements on X-ray data of diverse structures including disordered and covalent organic framework systems: a time-accuracy trade-off
Kunal Kumar Jha, Florian Kleemiss, Michał Leszek Chodkiewicz, et al.
Iucrj
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July 30, 2024
Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data
Michał Leszek Chodkiewicz, Barbara Olech, Kunal Kumar Jha, et al.
Journal of Chemical Information and Modeling
|
August 9, 2022
Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB
Kunal Kumar Jha, Barbara Gruza, Aleksandra Sypko, et al.
Journal of Applied Crystallography
|
April 10, 2026
<i>pyDiSCaMB</i>: enabling the use of multipolar scattering factors in <i>Phenix</i>
Viljar J Femoen, Laura Pacoste, Michał Leszek Chodkiewicz, et al.
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Search research articles
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Showing results (1-10 of 9) with videos related to
Sort By:
Page
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Iucrj
|
November 19, 2020
Hirshfeld atom like refinement with alternative electron density partitions
Michał Leszek Chodkiewicz, Magdalena Woińska, Krzysztof Woźniak
Acta Crystallographica. Section D, Structural Biology
|
August 2, 2022
Theoretical 3D electron diffraction electrostatic potential maps of proteins modeled with a multipolar pseudoatom data bank
Marta Kulik, Michał Leszek Chodkiewicz, Paulina Maria Dominiak
Acta Crystallographica. Section A, Foundations and Advances
|
January 8, 2020
Refinement of organic crystal structures with multipolar electron scattering factors
Barbara Gruza, Michał Leszek Chodkiewicz, Joanna Krzeszczakowska, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 4, 2016
An insight into real and average structure from diffuse X-ray scattering - a case study
Michał Leszek Chodkiewicz, Anna Makal, Roman Gajda, 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 Analysis
Paulina Maria Rybicka, Marta Kulik, Michał Leszek Chodkiewicz, et al.
Journal of Applied Crystallography
|
February 13, 2023
Aspherical atom refinements on X-ray data of diverse structures including disordered and covalent organic framework systems: a time-accuracy trade-off
Kunal Kumar Jha, Florian Kleemiss, Michał Leszek Chodkiewicz, et al.
Iucrj
|
July 30, 2024
Hirshfeld atom refinement and dynamical refinement of hexagonal ice structure from electron diffraction data
Michał Leszek Chodkiewicz, Barbara Olech, Kunal Kumar Jha, et al.
Journal of Chemical Information and Modeling
|
August 9, 2022
Multipolar Atom Types from Theory and Statistical Clustering (MATTS) Data Bank: Restructurization and Extension of UBDB
Kunal Kumar Jha, Barbara Gruza, Aleksandra Sypko, et al.
Journal of Applied Crystallography
|
April 10, 2026
<i>pyDiSCaMB</i>: enabling the use of multipolar scattering factors in <i>Phenix</i>
Viljar J Femoen, Laura Pacoste, Michał Leszek Chodkiewicz, et al.
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