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Non-Markovian Dynamic Models Identify Non-Canonical KRAS-VHL Encounter Complex Conformations for Novel PROTAC Design

JACS Au, 2024-10, Vol.4 (10), p.3857-3868

2024

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RNA extraction-free reduced graphene oxide-based RT-LAMP fluorescence assay for highly sensitive SARS-CoV-2 detection

Talanta (Oxford), 2024-09, Vol.277, p.126413, Article 126413

2024

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Information Bottleneck Approach for Markov Model Construction

Journal of chemical theory and computation, 2024-06, Vol.20 (12), p.5352-5367

2024

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Enhanced β relaxation induced by confinement in metallic glass film

Results in physics, 2024-06, Vol.61, p.107763, Article 107763

2024

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Tutorial on how to build non-Markovian dynamic models from molecular dynamics simulations for studying protein conformational changes

The Journal of chemical physics, 2024-03, Vol.160 (12)

2024

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Markov state modeling reveals chromatin destabilization in nucleosome condensates

Biophysical journal, 2024-02, Vol.123 (3), p.231a-231a

2024

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Modeling Dynamics of Multi-Body Systems via Machine Learning and Non-Markovian Approaches

Qiu, Yunrui

2024

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Lamellar sodium titanium silicate assembled by nanostrips decorated with N-rich 3D carbon for sodium dual-ion batteries

Chemical engineering journal (Lausanne, Switzerland : 1996), 2023-12, Vol.477, p.146737, Article 146737

2023

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Integrative generalized master equation: A method to study long-timescale biomolecular dynamics via the integrals of memory kernels

The Journal of chemical physics, 2023-10, Vol.159 (13)

2023

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A binary-heteroatom doped 3D multimode carbonaceous hybrids for high performance quasi-solid-state sodium dual-ion batteries

Carbon (New York), 2023-10, Vol.214, p.118312, Article 118312

2023

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GraphVAMPnets for uncovering slow collective variables of self-assembly dynamics

The Journal of chemical physics, 2023-09, Vol.159 (9)

2023

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An Efficient Path Classification Algorithm Based on Variational Autoencoder to Identify Metastable Path Channels for Complex Conformational Changes

Journal of chemical theory and computation, 2023-07, Vol.19 (14), p.4728-4742

2023

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An Efficient Path Classification Algorithm Based on Variational Auto-Encoder to Identify Metastable Path Channels for Complex Conformational Changes

Journal of chemical theory and computation, 2023-06, Vol.19 (14), p.4728-4742

2023

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Disease mutations and phosphorylation alter the allosteric pathways involved in autoinhibition of protein phosphatase 2A

The Journal of chemical physics, 2023-06, Vol.158 (21)

2023

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In vivo real-time red blood cell migration and microcirculation flow synergy imaging-surveyed thrombolytic therapy with iron-oxide complexes

Materials today bio, 2022-12, Vol.16, p.100408, Article 100408

2022

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The Ion-Dipole Correction of the 3DRISM Solvation Model to Accurately Compute Water Distributions around Negatively Charged Biomolecules

The journal of physical chemistry. B, 2022-11, Vol.126 (43), p.8632-8645

2022

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Kinetic network models to study molecular self-assembly in the wake of machine learning

MRS bulletin, 2022-09, Vol.47 (9), p.958-966

2022

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Fujian cytoplasmic male sterility and the fertility restorer gene OsRf19 provide a promising breeding system for hybrid rice

Proceedings of the National Academy of Sciences - PNAS, 2022-08, Vol.119 (34), p.1-e2208759119

2022

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Effects of zinc and iron on the abundance of Microcystis in Lake Taihu under green light and turbulence conditions

Environmental science and pollution research international, 2022-05, Vol.29 (25), p.37791-37803

2022

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General synthesis of single-atom catalysts with high metal loading using graphene quantum dots

Nature chemistry, 2021-09, Vol.13 (9), p.887-894

2021

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Efficient photoelectrochemical CO 2 conversion for selective acetic acid production

Science bulletin, 2021-07, Vol.66 (13), p.1296

2021

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Efficient photoelectrochemical CO2 conversion for selective acetic acid production

Science bulletin, 2021-07, Vol.66 (13), p.1296-1304

2021

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Surface Plasmon Enabling Nitrogen Fixation in Pure Water through a Dissociative Mechanism under Mild Conditions

Journal of the American Chemical Society, 2019-05, Vol.141 (19), p.7807-7814

2019

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Integrating Coordinates with Context for Information Extraction in Document Images

2019 International Conference on Document Analysis and Recognition (ICDAR), 2019, p.363-368

2019

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Comparative transcriptome resources of two Dysosma species (Berberidaceae) and molecular evolution of the CYP 719A gene in Podophylloideae

Molecular ecology resources, 2016-01, Vol.16 (1), p.228-241

2016

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Non-Markovian Dynamic Models Identify Non-Canonical KRAS-VHL Encounter Complex Conformations for Novel PROTAC Design

RNA extraction-free reduced graphene oxide-based RT-LAMP fluorescence assay for highly sensitive SARS-CoV-2 detection

Information Bottleneck Approach for Markov Model Construction

Enhanced β relaxation induced by confinement in metallic glass film

Tutorial on how to build non-Markovian dynamic models from molecular dynamics simulations for studying protein conformational changes

Markov state modeling reveals chromatin destabilization in nucleosome condensates

Modeling Dynamics of Multi-Body Systems via Machine Learning and Non-Markovian Approaches

Lamellar sodium titanium silicate assembled by nanostrips decorated with N-rich 3D carbon for sodium dual-ion batteries

Integrative generalized master equation: A method to study long-timescale biomolecular dynamics via the integrals of memory kernels

A binary-heteroatom doped 3D multimode carbonaceous hybrids for high performance quasi-solid-state sodium dual-ion batteries

GraphVAMPnets for uncovering slow collective variables of self-assembly dynamics

An Efficient Path Classification Algorithm Based on Variational Autoencoder to Identify Metastable Path Channels for Complex Conformational Changes

An Efficient Path Classification Algorithm Based on Variational Auto-Encoder to Identify Metastable Path Channels for Complex Conformational Changes

Disease mutations and phosphorylation alter the allosteric pathways involved in autoinhibition of protein phosphatase 2A

In vivo real-time red blood cell migration and microcirculation flow synergy imaging-surveyed thrombolytic therapy with iron-oxide complexes

The Ion-Dipole Correction of the 3DRISM Solvation Model to Accurately Compute Water Distributions around Negatively Charged Biomolecules

Kinetic network models to study molecular self-assembly in the wake of machine learning

Fujian cytoplasmic male sterility and the fertility restorer gene OsRf19 provide a promising breeding system for hybrid rice

Effects of zinc and iron on the abundance of Microcystis in Lake Taihu under green light and turbulence conditions

General synthesis of single-atom catalysts with high metal loading using graphene quantum dots

Efficient photoelectrochemical CO 2 conversion for selective acetic acid production

Efficient photoelectrochemical CO2 conversion for selective acetic acid production

Surface Plasmon Enabling Nitrogen Fixation in Pure Water through a Dissociative Mechanism under Mild Conditions

Integrating Coordinates with Context for Information Extraction in Document Images

Comparative transcriptome resources of two Dysosma species (Berberidaceae) and molecular evolution of the CYP 719A gene in Podophylloideae

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