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Chemical Engineering and Industrial Chemistry

Working Paper

Batch-Screening Guided Continuous Flow Synthesis of the Metal-organic Framework HKUST-1 in a Millifuidic Droplet Reactor

Rajasi Shukre, Thomas Ericson, Daniel Unruh, Hannah Harbin, Anthony Cozzolino, Chau-Chyun Chen, Siva Vanapalli

Version 1 posted 31 March 2022

406

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Physical Chemistry

Working Paper

Reliable and Accurate Prediction of Single Residue pKa Values Through Free Energy Perturbation Calculations

Dilek Coskun, Wei Chen, Anthony Clark, Chao Lu, Edward Harder, Lingle Wang, Richard Friesner, Edward Miller

Version 1 posted 21 September 2022

528

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Theoretical and Computational Chemistry

Working Paper

Hidden Bias in the DUD-E Dataset Leads to Misleading Performance of Deep Learning in Structure-Based Virtual Screening

Lieyang Chen, Anthony Cruz, Steven Ramsey, Callum J. Dickson, José S. Duca, Viktor Hornak, David R. Koes, Tom Kurtzman

Version 1 posted 25 March 2019

1,356

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2

Citations

Catalysis

Working Paper

DEET Degradation by Titanium Dioxide–Zeolite Nanocomposites: Effects of Aggregation State, Water Chemistry, and Natural Organic Matter

Tchemongo B. Berté, Anthony S. Chen, Riya A. Mathew, Sheyda Shakiba, Stacey M. Louie

Version 1 posted 13 October 2020

438

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1

Citations

Catalysis

Working Paper

Singlets-Driven Photoredox Catalysts: Transforming Noncatalytic Red Fluorophores to Efficient Catalysts

Sara Abuhadba, Charlotte Fuqua, Anthony Maltese, Caroline Schwinn, Neo Lin, Angela Chen, Rilee Martzloff, Tatiana Esipova, Tomoyasu Mani

Version 1 posted 07 October 2024

184

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Organic Chemistry

Working Paper

Enantioselective Total Synthesis of (–)-Myrifabral A and B

Tyler J. Fulton, Anthony Chen, Michael Bartberger, Brian Stoltz

Version 1 posted 27 February 2020

1,010

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Organic Chemistry

Working Paper

Convergent Total Synthesis of Principinol D, a Rearranged Kaurane Diterpenoid

Timothy Newhouse, Aneta Turlik, Yifeng Chen, Anthony Scruse

Version 4 posted 08 April 2019

1,782

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Polymer Science

Working Paper

Enabling Tunable Hydrophilicity of PDMS via Metal-ligand Coordinated Dynamic Networks

Xinyue Zhang, Ralph Crisci, John. A Finlay, Hongyi Cai, Anthony S. Clare, Zhan Chen, Meredith N. Silberstein

Version 1 posted 16 November 2021

321

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Biological and Medicinal Chemistry

Working Paper

An Online Repository of Solvation Thermodynamic and Structural Maps of SARS-CoV-2 Targets

Brian Olson, Anthony Cruz, Lieyang Chen, Mossa Ghattas, Yeonji Ji, Kunhui Huang, Daniel J. McKay, Tom Kurtzman

Version 1 posted 13 May 2020

738

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Theoretical and Computational Chemistry

Working Paper

Thermodynamic Decomposition of Solvation Free Energies with Particle Mesh Ewald and Long-Range Lennard-Jones Interactions in Grid Inhomogeneous Solvation Theory

Lieyang Chen, Anthony Cruz, Daniel R. Roe, Andrew Simmonett, Lauren Wickstrom, Nanjie Deng, Tom Kurtzman

Version 2 posted 17 November 2020

565

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13 results in Anthony Chen in Authors: Anthony Chen

Batch-Screening Guided Continuous Flow Synthesis of the Metal-organic Framework HKUST-1 in a Millifuidic Droplet Reactor

Reliable and Accurate Prediction of Single Residue pKa Values Through Free Energy Perturbation Calculations

Hidden Bias in the DUD-E Dataset Leads to Misleading Performance of Deep Learning in Structure-Based Virtual Screening

DEET Degradation by Titanium Dioxide–Zeolite Nanocomposites: Effects of Aggregation State, Water Chemistry, and Natural Organic Matter

Singlets-Driven Photoredox Catalysts: Transforming Noncatalytic Red Fluorophores to Efficient Catalysts

Enantioselective Total Synthesis of (–)-Myrifabral A and B

Convergent Total Synthesis of Principinol D, a Rearranged Kaurane Diterpenoid

Enabling Tunable Hydrophilicity of PDMS via Metal-ligand Coordinated Dynamic Networks

An Online Repository of Solvation Thermodynamic and Structural Maps of SARS-CoV-2 Targets

Thermodynamic Decomposition of Solvation Free Energies with Particle Mesh Ewald and Long-Range Lennard-Jones Interactions in Grid Inhomogeneous Solvation Theory

13 results in Authors: Anthony Chen