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Intermolecular Recognition of the Antimalarial Drug Chloroquine: A Quantum Theory of Atoms in Molecules–Density Functional Theory Investigation of the Hydrated Dihydrogen Phosphate Salt from the 103 K X‑ray Structure

Crystal growth & design, 2016-10, Vol.16 (10), p.6043-6054

2016

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Correlations of Crystal Structure and Solubility in Organic Salts: The Case of the Antiplasmodial Drug Piperaquine

Crystal growth & design, 2019-02, Vol.19 (2), p.1399-1410

2019

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Unraveling the Cooperative Mechanism of Visible-Light Absorption in Bulk N,Nb Codoped TiO2 Powders of Nanomaterials

Journal of physical chemistry. C, 2014-10, Vol.118 (41), p.24152-24164

2014

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Rationalizing the Lacking of Inversion Symmetry in a Noncentrosymmetric Polar Racemate: An Experimental and Theoretical Study

Crystal growth & design, 2014-11, Vol.14 (11), p.5822-5833

2014

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A variable-temperature X-ray diffraction and theoretical study of conformational polymorphism in a complex organic molecule (DTC)

RSC advances, 2018-11, Vol.8 (67), p.38445-38454

2018

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Competing CO···CO, C–H···O, Cl···O, and Cl···Cl Interactions Governing the Structural Phase Transition of 2,6-Dichloro‑p‑benzoquinone at T c = 122.6 K

Crystal growth & design, 2013-10, Vol.13 (10), p.4571-4582

2013

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Anharmonic motions versus dynamic disorder at the Mg ion from the charge densities in pyrope (Mg3Al2Si3O12) crystals at 30 K: six of one, half a dozen of the other

Acta crystallographica Section B, Structural science, crystal engineering and materials, 2017-08, Vol.73 (4), p.722-736

2017

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Single N–C Bond Becomes Shorter than a Formally Double NC Bond in a Thiazete-1,1-dioxide Crystal: An Experimental and Theoretical Study of Strong Crystal Field Effects

Crystal growth & design, 2014-09, Vol.14 (9), p.4418-4429

2014

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Observation of an exotic lattice structure in the transparent KTa1−xNbxO3 perovskite supercrystal

Physical review. B, 2020-12, Vol.102 (21), p.1

2020

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Observation of an exotic lattice structure in the transparent K Ta 1 − x Nb x O 3 perovskite supercrystal

Physical review. B, 2020-12, Vol.102 (21), Article 214110

2020

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A variable-temperature X-ray diffraction and theoretical study of conformational polymorphism in a complex organic molecule (DTC)Electronic supplementary information (ESI) available: Details of the energy decomposition schemes explored in this work; crystallographic and refinement details; eigenvalues of the translations and libration tensors describing the rigid body motion of the DTC asymmetric unit; TLS + H corrected fractional coordinates; conformational descriptors; crystal packing; hydroge

2018-11

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Unraveling the Cooperative Mechanism of Visible-Light Absorption in Bulk N,Nb Codoped TiO 2 Powders of Nanomaterials

Journal of physical chemistry. C, 2014-10, Vol.118 (41), p.24152-24164

2014

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Anharmonic motions versus dynamic disorder at the Mg ion from the charge densities in pyrope (Mg3Al2Si3O12) crystals at 30K: six of one, half a dozen of the other

Acta crystallographica. Section B, Structural science, 2017-08, Vol.73 (4), p.722

2017

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Competing C=O···C=O, C―H···O, Cl···O, and Cl...Cl Interactions Governing the Structural Phase Transition of 2,6-Dichloro-p-benzoquinone at Tc = 122.6 K

Crystal growth & design, 2013, Vol.13 (10), p.4571-4582

2013

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Decoding conformational polymorphism in organic substances

Acta crystallographica. Section A, Foundations and advances, 2014-08, Vol.70 (a1), p.C557-C557

2014

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Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion

Physical chemistry chemical physics : PCCP, 2009-01, Vol.11 (33), p.7181-7188

2009

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Crystal structure and structural phase transitions in the GdBaCo 2 O 5.0 cobaltite

Physical review. B, Condensed matter and materials physics, 2011-09, Vol.84 (10), Article 104107

2011

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On the role of data quality in experimental charge-density studies

Acta crystallographica. Section A, Foundations of crystallography, 2004-09, Vol.60 (5), p.365-370

2004

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No association between HPV vaccination and infertility in U.S. females 18–33 years old

Vaccine, 2020-05, Vol.38 (24), p.4038-4043

2020

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Engaging Communities in Cancer Prevention and Control Activity Prioritization through a Statewide Needs Assessment: A Case Study from Nebraska

Cancer prevention research (Philadelphia, Pa.), 2024-03, Vol.17 (3), p.97-106

2024

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Cross-Dressing of Multiple Myeloma Cells Mediated by Extracellular Vesicles Conveying MIC and ULBP Ligands Promotes NK Cell Killing

International journal of molecular sciences, 2023-05, Vol.24 (11), p.9467

2023

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3-O-Methyltolcapone and Its Lipophilic Analogues Are Potent Inhibitors of Transthyretin Amyloidogenesis with High Permeability and Low Toxicity

International journal of molecular sciences, 2023-12, Vol.25 (1), p.479

2023

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Computed tomography assessment of PEEP-induced alveolar recruitment in patients with severe COVID-19 pneumonia

Critical care (London, England), 2021-02, Vol.25 (1), p.81-81, Article 81

2021

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Lung distribution of gas and blood volume in critically ill COVID-19 patients: a quantitative dual-energy computed tomography study

Critical care (London, England), 2021-06, Vol.25 (1), p.214-214, Article 214

2021

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Intermolecular Recognition of the Antimalarial Drug Chloroquine: A Quantum Theory of Atoms in Molecules–Density Functional Theory Investigation of the Hydrated Dihydrogen Phosphate Salt from the 103 K X‑ray Structure

Correlations of Crystal Structure and Solubility in Organic Salts: The Case of the Antiplasmodial Drug Piperaquine

Unraveling the Cooperative Mechanism of Visible-Light Absorption in Bulk N,Nb Codoped TiO2 Powders of Nanomaterials

Rationalizing the Lacking of Inversion Symmetry in a Noncentrosymmetric Polar Racemate: An Experimental and Theoretical Study

A variable-temperature X-ray diffraction and theoretical study of conformational polymorphism in a complex organic molecule (DTC)

Competing CO···CO, C–H···O, Cl···O, and Cl···Cl Interactions Governing the Structural Phase Transition of 2,6-Dichloro‑p‑benzoquinone at T c = 122.6 K

Anharmonic motions versus dynamic disorder at the Mg ion from the charge densities in pyrope (Mg3Al2Si3O12) crystals at 30 K: six of one, half a dozen of the other

Single N–C Bond Becomes Shorter than a Formally Double NC Bond in a Thiazete-1,1-dioxide Crystal: An Experimental and Theoretical Study of Strong Crystal Field Effects

Observation of an exotic lattice structure in the transparent KTa1−xNbxO3 perovskite supercrystal

Observation of an exotic lattice structure in the transparent K Ta 1 − x Nb x O 3 perovskite supercrystal

Unraveling the Cooperative Mechanism of Visible-Light Absorption in Bulk N,Nb Codoped TiO 2 Powders of Nanomaterials

Anharmonic motions versus dynamic disorder at the Mg ion from the charge densities in pyrope (Mg3Al2Si3O12) crystals at 30K: six of one, half a dozen of the other

Competing C=O···C=O, C―H···O, Cl···O, and Cl...Cl Interactions Governing the Structural Phase Transition of 2,6-Dichloro-p-benzoquinone at Tc = 122.6 K

Decoding conformational polymorphism in organic substances

Detection and kinetics of the single-crystal to single-crystal complete transformation of a thiiranium ion into thietanium ion

Crystal structure and structural phase transitions in the GdBaCo 2 O 5.0 cobaltite

On the role of data quality in experimental charge-density studies

No association between HPV vaccination and infertility in U.S. females 18–33 years old

Engaging Communities in Cancer Prevention and Control Activity Prioritization through a Statewide Needs Assessment: A Case Study from Nebraska

Cross-Dressing of Multiple Myeloma Cells Mediated by Extracellular Vesicles Conveying MIC and ULBP Ligands Promotes NK Cell Killing

3-O-Methyltolcapone and Its Lipophilic Analogues Are Potent Inhibitors of Transthyretin Amyloidogenesis with High Permeability and Low Toxicity

Bronchoalveolar lavage fluid characteristics and outcomes of invasively mechanically ventilated patients with COVID-19 pneumonia in Genoa, Italy

Computed tomography assessment of PEEP-induced alveolar recruitment in patients with severe COVID-19 pneumonia

Lung distribution of gas and blood volume in critically ill COVID-19 patients: a quantitative dual-energy computed tomography study

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