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Flexible and high-sensitivity sensor based on Ti3C2–MoS2 MXene composite for the detection of toxic gases

Chemosphere (Oxford), 2022-03, Vol.291, p.133025-133025, Article 133025

2022

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Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

RSC advances, 2020-08, Vol.1 (53), p.31991-31996

2020

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Effect of Supports and Promoters on the Performance of Ni‐Based Catalysts in Ethanol Steam Reforming

Chemical engineering & technology, 2020-04, Vol.43 (4), p.672-688

2020

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Effective Estimation of Ligand-Binding Affinity Using Biased Sampling Method

ACS omega, 2019-02, Vol.4 (2), p.3887-3893

2019

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Stability evaluation of ethanol dry reforming on Lanthania‐doped cobalt‐based catalysts for hydrogen‐rich syngas generation

International journal of energy research, 2019-01, Vol.43 (1), p.405-416

2019

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Hierarchical Porous Activated Carbon-Supported Ruthenium Catalysts for Catalytic Cleavage of Lignin Model Compounds

Energies (Basel), 2022-11, Vol.15 (22), p.8611

2022

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One-Pot Synthesis of Au@SiO2 Catalysts: A Click Chemistry Approach

ACS combinatorial science, 2014-10, Vol.16 (10), p.513-517

2014

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Oversampling Free Energy Perturbation Simulation in Determination of the Ligand‐Binding Free Energy

Journal of computational chemistry, 2020-03, Vol.41 (7), p.611-618

2020

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Catalytic performance of La-Ni/Al2O3 catalyst for CO2 reforming of ethanol

Catalysis today, 2017-08, Vol.291, p.67-75

2017

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Surface-Bound Ligands Modulate Chemoselectivity and Activity of a Bimetallic Nanoparticle Catalyst

ACS catalysis, 2015-04, Vol.5 (4), p.2529-2533

2015

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Structural and Energetic Impact of Non‐natural 7‐Deaza‐8‐azaguanine, 7‐Deaza‐8‐azaisoguanine, and Their 7‐Substituted Derivatives on Hydrogen‐Bond Pairing with Cytosine and Isocytosine

Chembiochem : a European journal of chemical biology, 2019-09, Vol.20 (17), p.2262-2270

2019

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Distal Hydrophobic Loop Modulates the Copper Active Site and Reaction of AA13 Polysaccharide Monooxygenases

The journal of physical chemistry. B, 2022-10, Vol.126 (39), p.7567-7578

2022

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Polystyrene nanoparticles prepared by nanoprecipitation: A recyclable template for fabricating hollow silica

Journal of Industrial and Engineering Chemistry, 2021, 97(0), , pp.307-315

2021

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Palladium N‑Heterocyclic Carbene Precatalyst Site Isolated in the Core of a Star Polymer

Organic letters, 2015-10, Vol.17 (19), p.4826-4829

2015

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Atomistic investigation of an Iowa Amyloid-β trimer in aqueous solution

RSC advances, 2018-12, Vol.8 (73), p.41705-41712

2018

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Correction: Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

RSC advances, 2022-12, Vol.12 (55), p.35778-35778

2022

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Prediction of AChE-ligand affinity using the umbrella sampling simulation

Journal of molecular graphics & modelling, 2019-12, Vol.93, p.107441, Article 107441

2019

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Conjugated polymers: A systematic investigation of their electronic and geometric properties using density functional theory and semi-empirical methods

Synthetic metals, 2018-12, Vol.246, p.128-136

2018

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Marine derivatives prevent w MUS81 in silico studies

Royal Society open science, 2021-09, Vol.8 (9), p.210974

2021

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Marine derivatives prevent wMUS81 in silico studies

Royal Society open science, 2021-09, Vol.8 (9), p.210974-210974

2021

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cis-Cyclooctene epoxidation catalyzed by bulk metallophthalocyanines, metallohexadecafluorophthalocyanines and hollow silica-supported metallohexadecafluorophthalocyanine

Journal of Industrial and Engineering Chemistry, 2016, 40(0), , pp.40-46

2016

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Influence of Lanthanide Promoters on Ni/SBA-15 Catalysts for Syngas Production by Methane Dry Reforming

Procedia engineering, 2016, Vol.148, p.1388-1395

2016

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Fabrication of superhydrophobic surface using one-step chemical treatment

Surfaces and interfaces, 2020-12, Vol.21, p.100673, Article 100673

2020

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Ring opening metathesis polymerization of cyclopentene using a ruthenium catalyst confined by a branched polymer architecture

Polymer chemistry, 2016-01, Vol.7 (17), p.2923-2928

2016

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(Bio)Propylene production processes: A critical review

Journal of environmental chemical engineering, 2021-08, Vol.9 (4), p.105673, Article 105673

2021

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Flexible and high-sensitivity sensor based on Ti3C2–MoS2 MXene composite for the detection of toxic gases

Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

Effect of Supports and Promoters on the Performance of Ni‐Based Catalysts in Ethanol Steam Reforming

Effective Estimation of Ligand-Binding Affinity Using Biased Sampling Method

Stability evaluation of ethanol dry reforming on Lanthania‐doped cobalt‐based catalysts for hydrogen‐rich syngas generation

Hierarchical Porous Activated Carbon-Supported Ruthenium Catalysts for Catalytic Cleavage of Lignin Model Compounds

One-Pot Synthesis of Au@SiO2 Catalysts: A Click Chemistry Approach

Oversampling Free Energy Perturbation Simulation in Determination of the Ligand‐Binding Free Energy

Catalytic performance of La-Ni/Al2O3 catalyst for CO2 reforming of ethanol

Surface-Bound Ligands Modulate Chemoselectivity and Activity of a Bimetallic Nanoparticle Catalyst

Structural and Energetic Impact of Non‐natural 7‐Deaza‐8‐azaguanine, 7‐Deaza‐8‐azaisoguanine, and Their 7‐Substituted Derivatives on Hydrogen‐Bond Pairing with Cytosine and Isocytosine

Distal Hydrophobic Loop Modulates the Copper Active Site and Reaction of AA13 Polysaccharide Monooxygenases

Polystyrene nanoparticles prepared by nanoprecipitation: A recyclable template for fabricating hollow silica

Palladium N‑Heterocyclic Carbene Precatalyst Site Isolated in the Core of a Star Polymer

Atomistic investigation of an Iowa Amyloid-β trimer in aqueous solution

Correction: Rapid prediction of possible inhibitors for SARS-CoV-2 main protease using docking and FPL simulations

Prediction of AChE-ligand affinity using the umbrella sampling simulation

Conjugated polymers: A systematic investigation of their electronic and geometric properties using density functional theory and semi-empirical methods

Marine derivatives prevent w MUS81 in silico studies

Marine derivatives prevent wMUS81 in silico studies

cis-Cyclooctene epoxidation catalyzed by bulk metallophthalocyanines, metallohexadecafluorophthalocyanines and hollow silica-supported metallohexadecafluorophthalocyanine

Influence of Lanthanide Promoters on Ni/SBA-15 Catalysts for Syngas Production by Methane Dry Reforming

Fabrication of superhydrophobic surface using one-step chemical treatment

Ring opening metathesis polymerization of cyclopentene using a ruthenium catalyst confined by a branched polymer architecture

(Bio)Propylene production processes: A critical review

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