Search Results - "Zhao, Ruoqi"

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  1. 1

    Minimal Active Space for Diradicals Using Multistate Density Functional Theory by Han, Jingting, Zhao, Ruoqi, Guo, Yujie, Qu, Zexing, Gao, Jiali

    Published in Molecules (Basel, Switzerland) (27-05-2022)
    “…This work explores the electronic structure as well as the reactivity of singlet diradicals, making use of multistate density functional theory (MSDFT). In…”
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  2. 2

    Minimal-active-space multistate density functional theory for excitation energy involving local and charge transfer states by Zhao, Ruoqi, Hettich, Christian P., Chen, Xin, Gao, Jiali

    Published in npj computational materials (16-09-2021)
    “…Multistate density functional theory (MSDFT) employing a minimum active space (MAS) is presented to determine charge transfer (CT) and local excited states of…”
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  3. 3

    Study on the related factors of TCM constitution and hemodynamics in patients with coronary heart disease by Mao, Boyan, Zhao, Zhou, Wei, Minghui, Liu, Xinzhu, Zhao, Ruoqi, Zhang, Weipeng, Duan, Mengyao

    Published in Frontiers in cardiovascular medicine (11-03-2024)
    “…The concepts of "individualization" and "preventive treatment" should be incorporated into the precise diagnosis and treatment of coronary heart disease (CHD)…”
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  4. 4

    The Pea Oligosaccharides Could Stimulate the In Vitro Proliferation of Beneficial Bacteria and Enhance Anti-Inflammatory Effects via the NF-κB Pathway by Cheng, Yongxia, Zhao, Ruoqi, Qiao, Mingwu, Ma, Yan, Li, Tiange, Li, Ning, Shen, Yue, Huang, Xianqing, Song, Lianjun

    Published in Foods (01-02-2024)
    “…The oligosaccharides extracted from the seeds of peas, specifically consisting of raffinose, stachyose, and verbascose, fall under the category of raffinose…”
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  5. 5

    A mutli-scale spatial-temporal convolutional neural network with contrastive learning for motor imagery EEG classification by Zhao, Ruoqi, Wang, Yuwen, Cheng, Xiangxin, Zhu, Wanlin, Meng, Xia, Niu, Haijun, Cheng, Jian, Liu, Tao

    Published in Medicine in novel technology and devices (01-03-2023)
    “…Motor imagery (MI) based Brain-computer interfaces (BCIs) have a wide range of applications in the stroke rehabilitation field. However, due to the low…”
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  6. 6

    Material, design, and fabrication of custom prosthetic liners for lower-extremity amputees: A review by Yang, Xingbang, Zhao, Ruoqi, Solav, Dana, Yang, Xuan, Lee, Duncan R.C., Sparrman, Bjorn, Fan, Yubo, Herr, Hugh

    Published in Medicine in novel technology and devices (01-03-2023)
    “…As a physical interface, a prosthetic liner is commonly used as a transition material between the residual limb and the stiff socket. Typically made from a…”
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  7. 7

    Effects of Hand Positions During Video Head-Impulse Test (vHIT) in Patients With Unilateral Vestibular Neuritis by Fu, Wei, He, Feng, Zhao, Ruoqi, Wei, Dong, Bai, Ya, Wang, XiaoMing, Han, JunLiang

    Published in Frontiers in neurology (13-08-2018)
    “…The aim of this study is to identify the effects of hand positions (head and jaw) on the video head-impulse test (vHIT). Eighty-six healthy volunteers and…”
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  8. 8

    Excimer Energies by Zhao, Ruoqi, Hettich, Christian, Zhang, Jun, Liu, Meiyi, Gao, Jiali

    Published in The journal of physical chemistry letters (30-03-2023)
    “…A multistate energy decomposition analysis (MS-EDA) method is introduced for excimers using density functional theory. Although EDA has been widely applied to…”
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  9. 9

    Method and Implementation of Projected Hybrid Orbitals for Treating Multiple Covalent Bonds in Combined QM/MM Calculations by Zhao, Ruoqi, Wang, Yingjie, Gao, Jiali, Zhang, Jun

    Published in Journal of chemical theory and computation (26-11-2024)
    “…The projected hybrid orbital (PHO) method for treatment of multiple boundary atoms introduces a novel solution for handling the covalent connection between…”
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  10. 10

    Minimal Active Space: NOSCF and NOSI in Multistate Density Functional Theory by Lu, Yangyi, Zhao, Ruoqi, Zhang, Jun, Liu, Meiyi, Gao, Jiali

    Published in Journal of chemical theory and computation (08-11-2022)
    “…In this Perspective, we introduce a minimal active space (MAS) for the lowest N eigenstates of a molecular system in the framework of multistate density…”
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  11. 11

    The effect of microglia activation on cerebral injury induced by conditional Tpk knockout in brain neurons of adult mice and the mechanism exploration by Zhao, Ruoqi, Jin, Boru, Zhong, Chunjiu, Sang, Shaoming

    Published in Alzheimer's & dementia (01-12-2023)
    “…Background We previously designed and constructed the neuronal Tpk conditional knockout mouse model, which can simulate various pathophysiological changes of…”
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  12. 12

    Dynamic-then-Static Approach for Core Excitations of Open-Shell Molecules by Zhao, Ruoqi, Grofe, Adam, Wang, Zikuan, Bao, Peng, Chen, Xin, Liu, Wenjian, Gao, Jiali

    Published in The journal of physical chemistry letters (12-08-2021)
    “…Delta self-consistent-field methods are widely used in studies of electronically excited states. However, the nonaufbau determinants are generally…”
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  13. 13

    Leveling the Mountain Range of Excited-State Benchmarking through Multistate Density Functional Theory by Zhu, Hong, Zhao, Ruoqi, Lu, Yangyi, Liu, Meiyi, Zhang, Jun, Gao, Jiali

    “…The performance of multistate density functional theory (MSDFT) with nonorthogonal state interaction (NOSI) is assessed for 100 vertical excitation energies…”
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  14. 14

    Terrain-Aware Stride-Level Human Hip Joint Angle Forecasting via Vision and Kinematics Fusion by Zhao, Ruoqi, Yang, Xingbang, Fan, Yubo

    Published in IEEE robotics and automation letters (01-09-2024)
    “…Forecasting human joint angle has attracted considerable attention in the field of exoskeletons and prostheses, as one promising solution for human intention…”
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  15. 15

    Target State Optimized Density Functional Theory for Electronic Excited and Diabatic States by Zhang, Jun, Tang, Zhen, Zhang, Xiaoyong, Zhu, Hong, Zhao, Ruoqi, Lu, Yangyi, Gao, Jiali

    Published in Journal of chemical theory and computation (28-03-2023)
    “…A flexible self-consistent field method, called target state optimization (TSO), is presented for exploring electronic excited configurations and localized…”
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  16. 16

    Generalization of Block-Localized Wave Function for Constrained Optimization of Excited Determinants by Grofe, Adam, Zhao, Ruoqi, Wildman, Andrew, Stetina, Torin F, Li, Xiaosong, Bao, Peng, Gao, Jiali

    Published in Journal of chemical theory and computation (12-01-2021)
    “…The block-localized wave function method is useful to provide insights on chemical bonding and intermolecular interactions through energy decomposition…”
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  17. 17

    Measurement and decomposition of multidimensional poverty among migrant children: Evidence from China by Meng, Fanqiang, Zhou, Guanglu, Liu, Zhihui, Bhuiyan, Miraj Ahmed, Zhao, Ruoqi

    Published in Cities (01-07-2024)
    “…Our aim was to measure the multidimensional poverty of migrant children with the Alkire and Foster (A-F) method by using the 2020 China Family Panel Studies…”
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  18. 18

    Study on the mechanism of Shujin Tongluo granules in treating cervical spondylosis based on network pharmacology and molecular docking by Wang, Yixuan, Tao, Xiaoyu, Gao, Yifei, Jin, Zhengsen, Guo, Siyu, Li, Zhenjiang, Wang, Mengmeng, Zhao, Ruoqi, Zhou, Wei, Wu, Jiarui

    Published in Medicine (Baltimore) (21-07-2023)
    “…To investigate the potential active ingredients and possible mechanisms of Shujin Tongluo granules (SJTLG) in the treatment of cervical spondylosis (CS) by…”
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  19. 19

    LGNet: Learning local–global EEG representations for cognitive workload classification in simulated flights by Wang, Yuwen, Han, Mingxiu, Peng, Yudan, Zhao, Ruoqi, Fan, Dongqiong, Meng, Xia, Xu, Hong, Niu, Haijun, Cheng, Jian, Liu, Tao

    Published in Biomedical signal processing and control (01-06-2024)
    “…•EEG emerges as a promising tool for cognitive workload monitoring.•CNNs are effective in extracting local EEG representations but tend to have limitations in…”
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  20. 20

    Nobiletin-Ameliorated Lipopolysaccharide-Induced Inflammation in Acute Lung Injury by Suppression of NF-κB Pathway In Vivo and Vitro by Li, Weifeng, Zhao, Ruoqi, Wang, Xiumei, Liu, Fang, Zhao, Jinmeng, Yao, Qing, Zhi, Wenbing, He, Zehong, Niu, Xiaofeng

    Published in Inflammation (01-06-2018)
    “…Nobiletin (NOB), a citrus polymethoxy flavonoid, has been reported to exhibit anti-inflammatory, anti-cancer, and anti-insulin resistance activities. Although…”
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