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Dynamical transition orbitals: A particle–hole description in real-time TDDFT dynamics

The Journal of chemical physics, 2021-02, Vol.154 (5), p.054107-054107

2021

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Lithium hexamethyldisilazide initiated superfast ring opening polymerization of alpha-amino acid N-carboxyanhydrides

Nature communications, 2018-12, Vol.9 (1), p.5297-10, Article 5297

2018

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Simulating electronic excitation and dynamics with real-time propagation approach to TDDFT within plane-wave pseudopotential formulation

The Journal of chemical physics, 2021-09, Vol.155 (10), p.100901-100901

2021

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Efficient exact exchange using Wannier functions and other related developments in planewave-pseudopotential implementation of RT-TDDFT

The Journal of chemical physics, 2024-07, Vol.161 (2)

2024

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Theory of moment propagation for quantum dynamics in single-particle description

The Journal of chemical physics, 2024-02, Vol.160 (6)

2024

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Nuclear–electronic orbital approach to quantization of protons in periodic electronic structure calculations

The Journal of chemical physics, 2022-06, Vol.156 (22), p.224111-224111

2022

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The Gut Microbiota-Brain Axis: Potential Mechanism of Drug Addiction

Current topics in medicinal chemistry, 2023-01, Vol.23 (18), p.1782-1792

2023

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A novel gene therapy for methamphetamine- induced cognitive disorder with a hyper-acidified fusion variant of DnaJB1

Molecular therapy. Nucleic acids, 2023-03, Vol.31, p.703-716

2023

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Molecular Control of Floquet Topological Phase in Non-adiabatic Thouless Pumping

The journal of physical chemistry letters, 2023-09, Vol.14 (36), p.8205-8212

2023

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Targeted brain delivery of RVG29‐modified rifampicin‐loaded nanoparticles for Alzheimer's disease treatment and diagnosis

Bioengineering & translational medicine, 2022-09, Vol.7 (3), p.e10395-n/a

2022

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Exercise modulates central and peripheral inflammatory responses and ameliorates methamphetamine-induced anxiety-like symptoms in mice

Frontiers in molecular neuroscience, 2022-08, Vol.15, p.955799-955799

2022

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Complete OSV-MP2 Analytical Gradient Theory for Molecular Structure and Dynamics Simulations

Journal of chemical theory and computation, 2020-01, Vol.16 (1), p.196-210

2020

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First-Principles Theoretical Study of Non-Equilibrium Electron Dynamics and Electronic Excitation

Zhou, Ruiyi

2024

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Real-Time Time-Dependent Density Functional Theory for Simulating Nonequilibrium Electron Dynamics

Journal of the American Chemical Society, 2024-02, Vol.146 (8), p.5011-5029

2024

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First-Principles Demonstration of Nonadiabatic Thouless Pumping of Electrons in a Molecular System

The journal of physical chemistry letters, 2021-05, Vol.12 (19), p.4496-4503

2021

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Practical Preparation of Infection-Resistant Biomedical Surfaces from Antimicrobial β‑Peptide Polymers

ACS applied materials & interfaces, 2019-05, Vol.11 (21), p.18907-18913

2019

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First-Principles Approach for Coupled Quantum Dynamics of Electrons and Protons in Heterogeneous Systems

Physical review letters, 2023-12, Vol.131 (23), p.238002-238002, Article 238002

2023

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Peptide Polymer‐Doped Cement Acting as an Effective Treatment of MRSA‐Infected Chronic Osteomyelitis

Advanced functional materials, 2022-02, Vol.32 (7), p.n/a

2022

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Nuclear–electronic orbital approach to quantization of protons in periodic electronic structure calculations

The Journal of chemical physics, 2022-06, Vol.156 (22)

2022

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A Polymeric Strategy Empowering Vascular Cell Selectivity and Potential Application Superior to Extracellular Matrix Peptides

Advanced materials (Weinheim), 2022-10, Vol.34 (42), p.e2200464-n/a

2022

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Facile synthesis of polypeptoids bearing bulky sidechains via urea accelerated ring-opening polymerization of α-amino acid N -substituted N -carboxyanhydrides

Polymer chemistry, 2022-01, Vol.13 (3), p.420-426

2022

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Rifampicin ameliorates lipopolysaccharide-induced cognitive and motor impairments via inhibition of the TLR4/MyD88/NF-κB signaling pathway in mice

Neurological research (New York), 2021-05, Vol.43 (5), p.358-371

2021

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Rifampicin Suppresses Amyloid-β Accumulation Through Enhancing Autophagy in the Hippocampus of a Lipopolysaccharide-Induced Mouse Model of Cognitive Decline

Journal of Alzheimer's disease, 2021-01, Vol.79 (3), p.1171-1184

2021

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USP8 protects against lipopolysaccharide-induced cognitive and motor deficits by modulating microglia phenotypes through TLR4/MyD88/NF-κB signaling pathway in mice

Brain, behavior, and immunity, 2020-08, Vol.88, p.582-596

2020

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Dl‑butylphthalide inhibits rotenone‑induced oxidative stress in microglia via regulation of the Keap1/Nrf2/HO‑1 signaling pathway

Experimental and therapeutic medicine, 2021-06, Vol.21 (6), Article 597

2021

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Dynamical transition orbitals: A particle–hole description in real-time TDDFT dynamics

Lithium hexamethyldisilazide initiated superfast ring opening polymerization of alpha-amino acid N-carboxyanhydrides

Simulating electronic excitation and dynamics with real-time propagation approach to TDDFT within plane-wave pseudopotential formulation

Efficient exact exchange using Wannier functions and other related developments in planewave-pseudopotential implementation of RT-TDDFT

Theory of moment propagation for quantum dynamics in single-particle description

Nuclear–electronic orbital approach to quantization of protons in periodic electronic structure calculations

The Gut Microbiota-Brain Axis: Potential Mechanism of Drug Addiction

A novel gene therapy for methamphetamine- induced cognitive disorder with a hyper-acidified fusion variant of DnaJB1

Molecular Control of Floquet Topological Phase in Non-adiabatic Thouless Pumping

Targeted brain delivery of RVG29‐modified rifampicin‐loaded nanoparticles for Alzheimer's disease treatment and diagnosis

Exercise modulates central and peripheral inflammatory responses and ameliorates methamphetamine-induced anxiety-like symptoms in mice

Complete OSV-MP2 Analytical Gradient Theory for Molecular Structure and Dynamics Simulations

First-Principles Theoretical Study of Non-Equilibrium Electron Dynamics and Electronic Excitation

Real-Time Time-Dependent Density Functional Theory for Simulating Nonequilibrium Electron Dynamics

First-Principles Demonstration of Nonadiabatic Thouless Pumping of Electrons in a Molecular System

Practical Preparation of Infection-Resistant Biomedical Surfaces from Antimicrobial β‑Peptide Polymers

First-Principles Approach for Coupled Quantum Dynamics of Electrons and Protons in Heterogeneous Systems

Peptide Polymer‐Doped Cement Acting as an Effective Treatment of MRSA‐Infected Chronic Osteomyelitis

Nuclear–electronic orbital approach to quantization of protons in periodic electronic structure calculations

A Polymeric Strategy Empowering Vascular Cell Selectivity and Potential Application Superior to Extracellular Matrix Peptides

Facile synthesis of polypeptoids bearing bulky sidechains via urea accelerated ring-opening polymerization of α-amino acid N -substituted N -carboxyanhydrides

Rifampicin ameliorates lipopolysaccharide-induced cognitive and motor impairments via inhibition of the TLR4/MyD88/NF-κB signaling pathway in mice

Rifampicin Suppresses Amyloid-β Accumulation Through Enhancing Autophagy in the Hippocampus of a Lipopolysaccharide-Induced Mouse Model of Cognitive Decline

USP8 protects against lipopolysaccharide-induced cognitive and motor deficits by modulating microglia phenotypes through TLR4/MyD88/NF-κB signaling pathway in mice

Dl‑butylphthalide inhibits rotenone‑induced oxidative stress in microglia via regulation of the Keap1/Nrf2/HO‑1 signaling pathway

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