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High-throughput computational screening of metal-organic framework membranes for upgrading of natural gas

Journal of membrane science, 2018-04, Vol.551, p.47-54

2018

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Chiral BINOL-Based Covalent Organic Frameworks for Enantioselective Sensing

Journal of the American Chemical Society, 2019-05, Vol.141 (17), p.7081-7089

2019

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Computational screening of hydrophobic metal–organic frameworks for the separation of H2S and CO2 from natural gas

Journal of materials chemistry. A, Materials for energy and sustainability, 2018, Vol.6 (39), p.18898-18905

2018

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Machine Learning-Enabled Prediction and High-Throughput Screening of Polymer Membranes for Pervaporation Separation

ACS applied materials & interfaces, 2022-02, Vol.14 (6), p.8427-8436

2022

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Pore fluid evolution, distribution and water-rock interactions of carbonate cements in red-bed sandstone reservoirs in the Dongying Depression, China

Marine and petroleum geology, 2016-04, Vol.72, p.279-294

2016

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Computational Characterization of Ultrathin Polymer Membranes in Liquids

Macromolecules, 2018-09, Vol.51 (18), p.7169-7177

2018

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Characteristics and evolution of the late Permian “source-to-sink” system of the Beisantai area in the eastern Junggar Basin, NW China

Journal of Asian earth sciences, 2019-09, Vol.181, p.103907, Article 103907

2019

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Effects of functionalization on the nanofiltration performance of PIM-1: Molecular simulation investigation

Journal of membrane science, 2019-12, Vol.591, p.117357, Article 117357

2019

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A putative 6-transmembrane nitrate transporter OsNRT1.1b plays a key role in rice under low nitrogen

Journal of integrative plant biology, 2016-06, Vol.58 (6), p.590-599

2016

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A molecular simulation protocol for swelling and organic solvent nanofiltration of polymer membranes

Journal of membrane science, 2019-03, Vol.573, p.639-646

2019

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Molecular simulations of liquid separations in polymer membranes

Current opinion in chemical engineering, 2020-06, Vol.28, p.66-74

2020

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Rapid Screening of Metal–Organic Frameworks for Propane/Propylene Separation by Synergizing Molecular Simulation and Machine Learning

ACS applied materials & interfaces, 2021-11, Vol.13 (45), p.53454-53467

2021

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Recent development in machine learning of polymer membranes for liquid separation

Molecular systems design & engineering, 2022-08, Vol.7 (8), p.856-872

2022

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Machine Learning for Polymer Swelling in Liquids

ACS applied polymer materials, 2020-08, Vol.2 (8), p.3576-3586

2020

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Synergizing machine learning, molecular simulation and experiment to develop polymer membranes for solvent recovery

Journal of membrane science, 2023-07, Vol.678, p.121678, Article 121678

2023

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Molecular Simulation and Analysis of Sorption Process toward Theoretical Prediction for Liquid Permeation through Membranes

The journal of physical chemistry. B, 2018-12, Vol.122 (50), p.12211-12218

2018

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Free-standing homochiral 2D monolayers by exfoliation of molecular crystals

Nature (London), 2022-02, Vol.602 (7898), p.606-611

2022

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Gas permeation through double-layer graphene oxide membranes: The role of interlayer distance and pore offset

Separation and purification technology, 2019-01, Vol.209, p.419-425

2019

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High-Throughput Computational Screening of Metal–Organic Frameworks for Thiol Capture

Journal of physical chemistry. C, 2017-10, Vol.121 (40), p.22208-22215

2017

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Enantioselective trans-Dihydroxylation of Aryl Olefins by Cascade Biocatalysis with Recombinant Escherichia coli Coexpressing Monooxygenase and Epoxide Hydrolase

ACS catalysis, 2014-02, Vol.4 (2), p.409-420

2014

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Evaluation of polymer-preservative interactions for preservation efficacy: molecular dynamics simulation and QSAR approaches

Nanoscale, 2024-09, Vol.16 (36), p.17049-17063

2024

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Computational screening of hydrophobic metal–organic frameworks for the separation of H 2 S and CO 2 from natural gas

Journal of materials chemistry. A, Materials for energy and sustainability, 2018-10, Vol.6 (39), p.18898-18905

2018

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Computational screening of hydrophobic metal-organic frameworks for the separation of H2S and CO2 from natural gasElectronic supplementary information (ESI) available: Lennard-Jones parameters of MOFs; models of H2S, CO2, CH4, C2H6, and C3H8; Lennard-Jones parameters and charges of adsorbates; bond bending potentials of C3H8; adsorption capacities using two different GCMC cycles; adsorption isotherms of H2O in ZIF-8; total adsorption capacity and adsorption capacity of H2O; relationships between

2018-10

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Paleoclimate quantitative reconstruction and characteristics of continental red beds: a case study of the lower fourth sub-member of Shahejie Formation in the Bonan Sag

Journal of petroleum exploration and production technology, 2023-10, Vol.13 (10), p.1993-2014

2023

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Characteristics and Genesis of the Es1 Productive Sandstone Reservoir (Paleogene), Nanpu Sag, East China

Acta geologica Sinica (Beijing), 2021-06, Vol.95 (3), p.909-927

English ed., 2021

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High-throughput computational screening of metal-organic framework membranes for upgrading of natural gas

Chiral BINOL-Based Covalent Organic Frameworks for Enantioselective Sensing

Computational screening of hydrophobic metal–organic frameworks for the separation of H2S and CO2 from natural gas

Machine Learning-Enabled Prediction and High-Throughput Screening of Polymer Membranes for Pervaporation Separation

Pore fluid evolution, distribution and water-rock interactions of carbonate cements in red-bed sandstone reservoirs in the Dongying Depression, China

Computational Characterization of Ultrathin Polymer Membranes in Liquids

Characteristics and evolution of the late Permian “source-to-sink” system of the Beisantai area in the eastern Junggar Basin, NW China

Effects of functionalization on the nanofiltration performance of PIM-1: Molecular simulation investigation

A putative 6-transmembrane nitrate transporter OsNRT1.1b plays a key role in rice under low nitrogen

A molecular simulation protocol for swelling and organic solvent nanofiltration of polymer membranes

Molecular simulations of liquid separations in polymer membranes

Rapid Screening of Metal–Organic Frameworks for Propane/Propylene Separation by Synergizing Molecular Simulation and Machine Learning

Recent development in machine learning of polymer membranes for liquid separation

Machine Learning for Polymer Swelling in Liquids

Synergizing machine learning, molecular simulation and experiment to develop polymer membranes for solvent recovery

Molecular Simulation and Analysis of Sorption Process toward Theoretical Prediction for Liquid Permeation through Membranes

Free-standing homochiral 2D monolayers by exfoliation of molecular crystals

Gas permeation through double-layer graphene oxide membranes: The role of interlayer distance and pore offset

High-Throughput Computational Screening of Metal–Organic Frameworks for Thiol Capture

Enantioselective trans-Dihydroxylation of Aryl Olefins by Cascade Biocatalysis with Recombinant Escherichia coli Coexpressing Monooxygenase and Epoxide Hydrolase

Evaluation of polymer-preservative interactions for preservation efficacy: molecular dynamics simulation and QSAR approaches

Computational screening of hydrophobic metal–organic frameworks for the separation of H 2 S and CO 2 from natural gas

Paleoclimate quantitative reconstruction and characteristics of continental red beds: a case study of the lower fourth sub-member of Shahejie Formation in the Bonan Sag

Characteristics and Genesis of the Es1 Productive Sandstone Reservoir (Paleogene), Nanpu Sag, East China

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