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Journal Articles

Driven transport of active particles through arrays of symmetric obstacles

Shubhadip Nayak, Sohom Das, Poulami Bag, Tanwi Debnath, Pulak K. Ghosh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 164109 (2023)
https://doi.org/10.1063/5.0176523
Published: October 2023
View article titled, Driven transport of active particles through arrays of symmetric obstacles
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Journal Articles

Electronic coarse-graining of long conjugated molecules: Case study of non-fullerene acceptors

Andriy Zhugayevych, Kun-Han Lin, Denis Andrienko
Journal: The Journal of Chemical Physics
J. Chem. Phys. 159, 024107 (2023)
https://doi.org/10.1063/5.0155488
Published: July 2023
View article titled, Electronic coarse-graining of long conjugated molecules: Case study of non-fullerene acceptors
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Includes: Supplementary data
Journal Articles

Scaling behavior for the detachment of a self-propelling filament from an attractive surface

Guo-qiang Feng, Wen-de Tian
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 164901 (2023)
https://doi.org/10.1063/5.0145868
Published: April 2023
View article titled, Scaling behavior for the detachment of a self-propelling filament from an attractive surface
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Includes: Supplementary data
Journal Articles

Effect of surfactants on the elasticity of the liquid–liquid interface

Shunta Kikuchi, Hiroshi Watanabe
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 124901 (2023)
https://doi.org/10.1063/5.0138733
Published: March 2023
View article titled, Effect of surfactants on the elasticity of the liquid–liquid interface
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Journal Articles

Micro-mechanical insights into the stress transmission in strongly aggregating colloidal gel

Yezaz Ahmed Gadi Man, Divas Singh Dagur, Saikat Roy
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 124902 (2023)
https://doi.org/10.1063/5.0137851
Published: March 2023
View article titled, Micro-mechanical insights into the stress transmission in strongly aggregating colloidal gel
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Journal Articles

Computational modeling of passive transport of functionalized nanoparticles

Daniela Moreno-Chaparro, Nicolas Moreno, Florencio Balboa Usabiaga, Marco Ellero
Journal: The Journal of Chemical Physics
J. Chem. Phys. 158, 104108 (2023)
https://doi.org/10.1063/5.0136833
Published: March 2023
View article titled, Computational modeling of passive transport of functionalized nanoparticles
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Journal Articles

Compression-induced buckling of a semiflexible filament in two and three dimensions

Ananya Mondal, Greg Morrison
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 104903 (2022)
https://doi.org/10.1063/5.0104910
Published: September 2022
View article titled, Compression-induced buckling of a semiflexible filament in two and three dimensions
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Journal Articles

A density scaling conjecture for aging glasses

Kristine Niss
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 054503 (2022)
https://doi.org/10.1063/5.0090869
Published: August 2022
View article titled, A density scaling conjecture for aging glasses
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Journal Articles

Observation of conformational dynamics in single light-harvesting proteins from cryptophyte algae

Raymundo Moya, Audrey C. Norris, Leah C. Spangler, Gregory D. Scholes, Gabriela S. Schlau-Cohen
Journal: The Journal of Chemical Physics
J. Chem. Phys. 157, 035102 (2022)
https://doi.org/10.1063/5.0095763
Published: July 2022
View article titled, Observation of conformational dynamics in single light-harvesting proteins from cryptophyte algae
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Includes: Supplementary data
Journal Articles

Alignment and propulsion of squirmer pusher–puller dumbbells

Judit Clopés, Gerhard Gompper, Roland G. Winkler
Journal: The Journal of Chemical Physics
J. Chem. Phys. 156, 194901 (2022)
https://doi.org/10.1063/5.0091067
Published: May 2022
View article titled, Alignment and propulsion of squirmer pusher–puller dumbbells
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Includes: Supplementary data
Journal Articles

Insight from high-pressure dielectric studies into molecular dynamics of the itraconazole-glycerol mixture in smectic and isotropic phases

Marzena Rams-Baron, Małgorzata Musiał, Daniel Kramarczyk, Marian Paluch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 156, 154501 (2022)
https://doi.org/10.1063/5.0080726
Published: April 2022
View article titled, Insight from high-pressure dielectric studies into molecular dynamics of the itraconazole-glycerol mixture in smectic and isotropic phases
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Journal Articles

Nascent structure memory erased in polymer stretching

Wen Luo, Yihuan Yu, Jiping Wang, Wenbing Hu
Journal: The Journal of Chemical Physics
J. Chem. Phys. 156, 144904 (2022)
https://doi.org/10.1063/5.0083952
Published: April 2022
View article titled, Nascent structure memory erased in polymer stretching
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Journal Articles

The microscopic origin of the anomalous isotopic properties of ice relies on the strong quantum anharmonic regime of atomic vibration

Marco Cherubini, Lorenzo Monacelli, Francesco Mauri
Journal: The Journal of Chemical Physics
J. Chem. Phys. 155, 184502 (2021)
https://doi.org/10.1063/5.0062689
Published: November 2021
View article titled, The microscopic origin of the anomalous isotopic properties of ice relies on the strong quantum anharmonic regime of atomic vibration
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Journal Articles

Mutual information analysis of the dynamic correlation between side chains in proteins

Naoyuki Miyashita, Yasushige Yonezawa
Journal: The Journal of Chemical Physics
J. Chem. Phys. 155, 044107 (2021)
https://doi.org/10.1063/5.0055662
Published: July 2021
View article titled, Mutual information analysis of the dynamic correlation between side chains in proteins
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Journal Articles

Impacts of mutations on dynamic allostery of adenylate kinase

Haoyu Song, Yanee Wutthinitikornkit, Xiaozhou Zhou, Jingyuan Li
Journal: The Journal of Chemical Physics
J. Chem. Phys. 155, 035101 (2021)
https://doi.org/10.1063/5.0053715
Published: July 2021
View article titled, Impacts of mutations on dynamic allostery of adenylate kinase
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Includes: Supplementary data
Journal Articles

Inelastic neutron scattering analysis with time-dependent Gaussian-field models

Cedric J. Gommes, Reiner Zorn, Sebastian Jaksch, Henrich Frielinghaus, Olaf Holderer
Journal: The Journal of Chemical Physics
J. Chem. Phys. 155, 024121 (2021)
https://doi.org/10.1063/5.0053446
Published: July 2021
View article titled, Inelastic neutron scattering analysis with time-dependent Gaussian-field models
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Includes: Supplementary data
Journal Articles

Spatial arrangements of spherical nanoparticles on lipid vesicles

Eric J. Spangler, Mohamed Laradji
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 244902 (2021)
https://doi.org/10.1063/5.0054875
Published: June 2021
View article titled, Spatial arrangements of spherical nanoparticles on lipid vesicles
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Journal Articles

Identifying systematic errors in a power spectral analysis of simulated lipid membranes

Muhammed F. Ergüder, Markus Deserno
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 214103 (2021)
https://doi.org/10.1063/5.0049448
Published: June 2021
View article titled, Identifying systematic errors in a power spectral analysis of simulated lipid membranes
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Journal Articles

A hybrid topological and shape-matching approach for structure analysis

Amrita Goswami, Jayant K. Singh
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 154502 (2021)
https://doi.org/10.1063/5.0046419
Published: April 2021
View article titled, A hybrid topological and shape-matching approach for structure analysis
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Includes: Supplementary data
Journal Articles

Dynamics of domain boundaries at metal–organic interfaces

Sara Pazoki, Jordan Frick, Daniel B. Dougherty
Journal: The Journal of Chemical Physics
J. Chem. Phys. 154, 124704 (2021)
https://doi.org/10.1063/5.0029313
Published: March 2021
View article titled, Dynamics of domain boundaries at metal–organic interfaces
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