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Direct Visible-Light-Excited Asymmetric Lewis Acid Catalysis of Intermolecular [2+2] Photocycloadditions

Journal of the American Chemical Society, 2017-07, Vol.139 (27), p.9120-9123

2017

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A molecular mechanism of artemisinin resistance in Plasmodium falciparum malaria

Nature (London), 2015-04, Vol.520 (7549), p.683-687

2015

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Mechanism, Reactivity, and Selectivity in Palladium-Catalyzed Redox-Relay Heck Arylations of Alkenyl Alcohols

Journal of the American Chemical Society, 2014-02, Vol.136 (5), p.1960-1967

2014

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Proofreading experimentally assigned stereochemistry through Q2MM predictions in Pd-catalyzed allylic aminations

Nature communications, 2021-11, Vol.12 (1), p.6719-6719, Article 6719

2021

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Strategic elements in computer-assisted retrosynthesis: A case study of the pupukeanane natural products

Tetrahedron, 2022-01, Vol.104, p.132584, Article 132584

2022

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Investigating the Nature of Palladium Chain-Walking in the Enantioselective Redox-Relay Heck Reaction of Alkenyl Alcohols

Journal of organic chemistry, 2014-12, Vol.79 (24), p.11841-11850

2014

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SET-Induced Biaryl Cross-Coupling: An SRN1 Reaction

Journal of organic chemistry, 2014-03, Vol.79 (6), p.2771-2774

2014

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Automated fitting of transition state force fields for biomolecular simulations

PloS one, 2022-03, Vol.17 (3), p.e0264960-e0264960

2022

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The Increasingly Complex Mechanism of HMG-CoA Reductase

Accounts of chemical research, 2013-11, Vol.46 (11), p.2416-2426

2013

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Computational Organometallic Chemistry

1. Aufl., 2012

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Diastereoselectivity in Lewis-Acid-Catalyzed Mukaiyama Aldol Reactions: A DFT Study

Journal of the American Chemical Society, 2012-09, Vol.134 (36), p.14973-14981

2012

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Prediction of Enantioselectivity in Rhodium Catalyzed Hydrogenations

Journal of the American Chemical Society, 2009-01, Vol.131 (2), p.410-411

2009

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Comparative Genome-Scale Metabolic Reconstruction and Flux Balance Analysis of Multiple Staphylococcus aureus Genomes Identify Novel Antimicrobial Drug Targets

Journal of Bacteriology, 2009-06, Vol.191 (12), p.4015-4024

2009

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Synthesis and Histone Deacetylase Inhibitory Activity of Largazole Analogs: Alteration of the Zinc-Binding Domain and Macrocyclic Scaffold

Organic letters, 2009-03, Vol.11 (6), p.1301-1304

2009

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Production of Proteins of the SARS-CoV‑2 Proteome for Drug Discovery

ACS omega, 2021-08, Vol.6 (30), p.19983-19994

2021

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Internal and External Stereoisomers of Squaraine Rotaxane Endoperoxide: Synthesis, Chemical Differences, and Structural Revision

Journal of organic chemistry, 2014-02, Vol.79 (3), p.1120-1130

2014

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Molecular Modeling of the Reaction Pathway and Hydride Transfer Reactions of HMG-CoA Reductase

Biochemistry (Easton), 2012-10, Vol.51 (40), p.7983-7995

2012

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Hydroxyl Radical's Role in the Remediation of a Common Herbicide, 2,4-Dichlorophenoxyacetic Acid (2,4-D)

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2004-12, Vol.108 (50), p.10925-10933

2004

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Stereoselectivity in Asymmetric Catalysis: The Case of Ruthenium-Catalyzed Ketone Hydrogenation

Journal of chemical theory and computation, 2014-06, Vol.10 (6), p.2427-2435

2014

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On the Mechanism of the Palladium Catalyzed Intramolecular Pauson−Khand-Type Reaction

Journal of organic chemistry, 2009-07, Vol.74 (14), p.5049-5058

2009

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Synergy of Combining Sonolysis and Photocatalysis in the Degradation and Mineralization of Chlorinated Aromatic Compounds

Environmental science & technology, 2003-05, Vol.37 (9), p.1926-1932

2003

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Regioselective Alkylation of Pyridinium Riboses

European journal of organic chemistry, 2020-01, Vol.2020 (4), p.446-449

2020

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Synthesis and photochemical behavior of coumarin-caged cholesterol

Bioorganic & medicinal chemistry letters, 2013-04, Vol.23 (7), p.2162-2165

2013

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Development of a Q2MM Force Field for the Asymmetric Rhodium Catalyzed Hydrogenation of Enamides

Journal of chemical theory and computation, 2008-08, Vol.4 (8), p.1313-1323

2008

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Mild and Efficient Desymmetrization of Diynes via Hydroamination: Application to the Synthesis of (±)-Monomorine I

Journal of organic chemistry, 2010-02, Vol.75 (4), p.1325-1328

2010

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Direct Visible-Light-Excited Asymmetric Lewis Acid Catalysis of Intermolecular [2+2] Photocycloadditions

A molecular mechanism of artemisinin resistance in Plasmodium falciparum malaria

Mechanism, Reactivity, and Selectivity in Palladium-Catalyzed Redox-Relay Heck Arylations of Alkenyl Alcohols

Proofreading experimentally assigned stereochemistry through Q2MM predictions in Pd-catalyzed allylic aminations

Strategic elements in computer-assisted retrosynthesis: A case study of the pupukeanane natural products

Investigating the Nature of Palladium Chain-Walking in the Enantioselective Redox-Relay Heck Reaction of Alkenyl Alcohols

SET-Induced Biaryl Cross-Coupling: An SRN1 Reaction

Automated fitting of transition state force fields for biomolecular simulations

The Increasingly Complex Mechanism of HMG-CoA Reductase

Computational Organometallic Chemistry

Diastereoselectivity in Lewis-Acid-Catalyzed Mukaiyama Aldol Reactions: A DFT Study

Prediction of Enantioselectivity in Rhodium Catalyzed Hydrogenations

Comparative Genome-Scale Metabolic Reconstruction and Flux Balance Analysis of Multiple Staphylococcus aureus Genomes Identify Novel Antimicrobial Drug Targets

Synthesis and Histone Deacetylase Inhibitory Activity of Largazole Analogs: Alteration of the Zinc-Binding Domain and Macrocyclic Scaffold

Production of Proteins of the SARS-CoV‑2 Proteome for Drug Discovery

Internal and External Stereoisomers of Squaraine Rotaxane Endoperoxide: Synthesis, Chemical Differences, and Structural Revision

Molecular Modeling of the Reaction Pathway and Hydride Transfer Reactions of HMG-CoA Reductase

Hydroxyl Radical's Role in the Remediation of a Common Herbicide, 2,4-Dichlorophenoxyacetic Acid (2,4-D)

Stereoselectivity in Asymmetric Catalysis: The Case of Ruthenium-Catalyzed Ketone Hydrogenation

On the Mechanism of the Palladium Catalyzed Intramolecular Pauson−Khand-Type Reaction

Synergy of Combining Sonolysis and Photocatalysis in the Degradation and Mineralization of Chlorinated Aromatic Compounds

Regioselective Alkylation of Pyridinium Riboses

Synthesis and photochemical behavior of coumarin-caged cholesterol

Development of a Q2MM Force Field for the Asymmetric Rhodium Catalyzed Hydrogenation of Enamides

Mild and Efficient Desymmetrization of Diynes via Hydroamination: Application to the Synthesis of (±)-Monomorine I

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