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Earth, Space, and Environmental Chemistry

Working Paper

Wildfire Smoke Impacts on Indoor Air Quality Assessed Using Crowdsourced Data in California

Yutong Liang, Deep Sengupta, Mark Joseph Campmier, Joshua Apte, David M. Lunderberg, Allen Goldstein

Version 2 posted 14 July 2021

680

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Biological and Medicinal Chemistry

Working Paper

Prediction of Chameleonic Efficiency

Laurent David, Mark Wenlock, Patrick Barton, Andreas Ritzén

Version 1 posted 10 June 2021

2,306

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Materials Chemistry

Working Paper

Sol-Gel Processing of a Covalent Organic Framework for the Generation of Hierarchically Porous Monolithic Adsorbents

Mark Carrington, Nakul Rampal, David G. Madden, Daniel O'Nolan, Nicola Pietro Maria Casati, Giorgio Divitini, Ritums Cepitis, Jesus A. Martin Ilan, Ceren Camur, Joaquin Silvestre-Albero, Felix Zamora, Sergei Taraskin, Karena W. Chapman, David Fairen-Jimenez

Version 1 posted 08 April 2021

865

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Inorganic Chemistry

Working Paper

Magnetic Structure of UO2 and NpO2 by First-Principle Methods

James Pegg, Ashley E. Shields, Mark T. Storr, Andrew S. Wills, David Scanlon, Nora De Leeuw

Version 2 posted 06 August 2018

1,269

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Theoretical and Computational Chemistry

Working Paper

Simplified Computational Model for Generating Biological Networks

Matthew Bailey, David Ormrod Morley, Mark Wilson

Version 1 posted 17 July 2020

192

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Organic Chemistry

Working Paper

Exploiting Chemical Diversity through C–H Activation and DNA-Encoding

Zhoulong Fan, Shuai Zhao, Tao Liu, Peng-Xiang Shen, Zi-Ning Cui, Zhe Zhuang, Qian Shao, Jason Chen, Anokha S. Ratnayake, Mark E. Flanagan, Dominik K. Kölmel, David W. Piotrowski, Paul Richardson, jin-quan yu

Version 1 posted 08 January 2020

1,352

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2

Citations

Theoretical and Computational Chemistry

Working Paper

Interaction of Hydrogen with Actinide Dioxide (011) Surfaces

James Pegg, Ashley E. Shields, Mark T. Storr, David Scanlon, Nora De Leeuw

Version 2 posted 08 April 2020

562

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Catalysis

Working Paper

Engineering Protein Dynamics of Ancestral Luciferase

Andrea Schenkmayerova, Gaspar Pinto, Martin Toul, Martin Marek, Lenka Hernychova, Joan Planas-Iglesias, Veronika Liskova, Daniel Pluskal, Michal Vasina, Stephane Emond, Mark Doerr, Radka Chaloupková, David Bednar, Zbynek Prokop, Florian Hollfelder, Uwe T. Bornscheuer, Jiri Damborsky

Version 1 posted 17 August 2020

379

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1

Citations

Theoretical and Computational Chemistry

Working Paper

On The Importance of Accurate Algorithms for Reliable Molecular Dynamics Simulations

Berk Hess, David van der Spoel, Mark J. Abraham, Erik Lindahl

Version 1 posted 31 December 2019

2,384

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6

Citations

Organic Chemistry

Working Paper

RASS-Enabled S/P–C and S–N Bond Formation for DEL Synthesis

Dillon T. Flood, Xuejing Zhang, Xiang Fu, Zhenxiang Zhao, Shota Asai, Brittany Sanchez, Emily J. Sturgell, Julien C. Vantourout, Paul Richardson, Mark E. Flanagan, David W. Piotrowski, Dominik K Kölmel, Jinqiao Wan, Yong Chang, Zhao Wang, Jason Chen, Phil Baran, Philip Dawson

Version 2 posted 08 January 2020

1,357

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49 results in Mark David in Authors: Mark David

Wildfire Smoke Impacts on Indoor Air Quality Assessed Using Crowdsourced Data in California

Prediction of Chameleonic Efficiency

Sol-Gel Processing of a Covalent Organic Framework for the Generation of Hierarchically Porous Monolithic Adsorbents

Magnetic Structure of UO2 and NpO2 by First-Principle Methods

Simplified Computational Model for Generating Biological Networks

Exploiting Chemical Diversity through C–H Activation and DNA-Encoding

Interaction of Hydrogen with Actinide Dioxide (011) Surfaces

Engineering Protein Dynamics of Ancestral Luciferase

On The Importance of Accurate Algorithms for Reliable Molecular Dynamics Simulations

RASS-Enabled S/P–C and S–N Bond Formation for DEL Synthesis

49 results in Authors: Mark David