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Acta Crystallographica. Section A, Foundations and Advances
|
March 2, 2018
Development of a joint refinement model for the spin-resolved one-electron reduced density matrix using different data sets
Saber Gueddida, Zeyin Yan, Jean Michel Gillet
Journal of Chemical Theory and Computation
|
May 25, 2021
Multiscale Quantum Refinement Approaches for Metalloproteins
Zeyin Yan, Xin Li, Lung Wa Chung
Nature Communications
|
May 16, 2024
Accelerating reliable multiscale quantum refinement of protein-drug systems enabled by machine learning
Zeyin Yan, Dacong Wei, Xin Li, et al.
The Journal of Physical Chemistry Letters
|
January 27, 2023
Quantum Tunneling in Reactions Modulated by External Electric Fields: Reactivity and Selectivity
Zhifeng Ma, Zeyin Yan, Xin Li, et al.
Chemical Science
|
January 9, 2025
An efficient and flexible approach for local distortion: distortion distribution analysis enabled by fragmentation
Zeyin Yan, Yunteng Sam Liao, Xin Li, et al.
The Journal of Chemical Physics
|
May 3, 2018
Joint refinement model for the spin resolved one-electron reduced density matrix of YTiO<sub>3</sub> using magnetic structure factors and magnetic Compton profiles data
Saber Gueddida, Zeyin Yan, Iurii Kibalin, et al.
Journal of Inorganic Biochemistry
|
September 5, 2017
Reactivity of 12-tungstophosphoric acid and its inhibitor potency toward Na<sup>+</sup>/K<sup>+</sup>-ATPase: A combined <sup>31</sup>P NMR study, ab initio calculations and crystallographic analysis
Nada Bošnjaković-Pavlović, Danica Bajuk-Bogdanović, Joanna Zakrzewska, et al.
Communications Chemistry
|
May 12, 2025
Author Correction: Structure-property relationships of photofunctional diiridium(II) complexes with tetracationic charge and an unsupported Ir-Ir bond
Fangrui Zheng, Yuhong Yang, Siye Wu, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 2, 2017
When combined X-ray and polarized neutron diffraction data challenge high-level calculations: spin-resolved electron density of an organic radical
Ariste Bolivard Voufack, Nicolas Claiser, Claude Lecomte, et al.
Communications Chemistry
|
January 25, 2023
Structure-property relationships of photofunctional diiridium(II) complexes with tetracationic charge and an unsupported Ir-Ir bond
Fangrui Zheng, Yuhong Yang, Siye Wu, et al.
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Showing results (1-10 of 11) with videos related to
Sort By:
Page
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Acta Crystallographica. Section A, Foundations and Advances
|
March 2, 2018
Development of a joint refinement model for the spin-resolved one-electron reduced density matrix using different data sets
Saber Gueddida, Zeyin Yan, Jean Michel Gillet
Journal of Chemical Theory and Computation
|
May 25, 2021
Multiscale Quantum Refinement Approaches for Metalloproteins
Zeyin Yan, Xin Li, Lung Wa Chung
Nature Communications
|
May 16, 2024
Accelerating reliable multiscale quantum refinement of protein-drug systems enabled by machine learning
Zeyin Yan, Dacong Wei, Xin Li, et al.
The Journal of Physical Chemistry Letters
|
January 27, 2023
Quantum Tunneling in Reactions Modulated by External Electric Fields: Reactivity and Selectivity
Zhifeng Ma, Zeyin Yan, Xin Li, et al.
Chemical Science
|
January 9, 2025
An efficient and flexible approach for local distortion: distortion distribution analysis enabled by fragmentation
Zeyin Yan, Yunteng Sam Liao, Xin Li, et al.
The Journal of Chemical Physics
|
May 3, 2018
Joint refinement model for the spin resolved one-electron reduced density matrix of YTiO<sub>3</sub> using magnetic structure factors and magnetic Compton profiles data
Saber Gueddida, Zeyin Yan, Iurii Kibalin, et al.
Journal of Inorganic Biochemistry
|
September 5, 2017
Reactivity of 12-tungstophosphoric acid and its inhibitor potency toward Na<sup>+</sup>/K<sup>+</sup>-ATPase: A combined <sup>31</sup>P NMR study, ab initio calculations and crystallographic analysis
Nada Bošnjaković-Pavlović, Danica Bajuk-Bogdanović, Joanna Zakrzewska, et al.
Communications Chemistry
|
May 12, 2025
Author Correction: Structure-property relationships of photofunctional diiridium(II) complexes with tetracationic charge and an unsupported Ir-Ir bond
Fangrui Zheng, Yuhong Yang, Siye Wu, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|
August 2, 2017
When combined X-ray and polarized neutron diffraction data challenge high-level calculations: spin-resolved electron density of an organic radical
Ariste Bolivard Voufack, Nicolas Claiser, Claude Lecomte, et al.
Communications Chemistry
|
January 25, 2023
Structure-property relationships of photofunctional diiridium(II) complexes with tetracationic charge and an unsupported Ir-Ir bond
Fangrui Zheng, Yuhong Yang, Siye Wu, et al.
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