Machine Learning for Electrocatalyst and Photocatalyst Design and Discovery
Mai, Haoxin, Le, Tu C., Chen, Dehong, Winkler, David A., Caruso, Rachel A.
Published in Chemical reviews (24.08.2022)
Published in Chemical reviews (24.08.2022)
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Understanding the Roles of the “Two QSARs”
Fujita, Toshio, Winkler, David A
Published in Journal of chemical information and modeling (22.02.2016)
Published in Journal of chemical information and modeling (22.02.2016)
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Computational Modeling and Simulation of CO2 Capture by Aqueous Amines
Yang, Xin, Rees, Robert J, Conway, William, Puxty, Graeme, Yang, Qi, Winkler, David A
Published in Chemical reviews (26.07.2017)
Published in Chemical reviews (26.07.2017)
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QSAR without borders
Muratov, Eugene N, Bajorath, Jürgen, Sheridan, Robert P, Tetko, Igor V, Filimonov, Dmitry, Poroikov, Vladimir, Oprea, Tudor I, Baskin, Igor I, Varnek, Alexandre, Roitberg, Adrian, Isayev, Olexandr, Curtalolo, Stefano, Fourches, Denis, Cohen, Yoram, Aspuru-Guzik, Alan, Winkler, David A, Agrafiotis, Dimitris, Cherkasov, Artem, Tropsha, Alexander
Published in Chemical Society reviews (07.06.2020)
Published in Chemical Society reviews (07.06.2020)
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Quantitative Structure–Property Relationship Modeling of Diverse Materials Properties
Le, Tu, Epa, V. Chandana, Burden, Frank R, Winkler, David A
Published in Chemical reviews (09.05.2012)
Published in Chemical reviews (09.05.2012)
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Converting Nanotoxicity Data to Information Using Artificial Intelligence and Simulation
Yan, Xiliang, Yue, Tongtao, Winkler, David A., Yin, Yongguang, Zhu, Hao, Jiang, Guibin, Yan, Bing
Published in Chemical reviews (12.07.2023)
Published in Chemical reviews (12.07.2023)
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A bright future for engineering piezoelectric 2D crystals
Sherrell, Peter C, Fronzi, Marco, Shepelin, Nick A, Corletto, Alexander, Winkler, David A, Ford, Mike, Shapter, Joseph G, Ellis, Amanda V
Published in Chemical Society reviews (24.01.2022)
Published in Chemical Society reviews (24.01.2022)
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Journal Article
Materials Genome in Action: Identifying the Performance Limits of Physical Hydrogen Storage
Thornton, Aaron W, Simon, Cory M, Kim, Jihan, Kwon, Ohmin, Deeg, Kathryn S, Konstas, Kristina, Pas, Steven J, Hill, Matthew R, Winkler, David A, Haranczyk, Maciej, Smit, Berend
Published in Chemistry of materials (11.04.2017)
Published in Chemistry of materials (11.04.2017)
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Quantitative design rules for protein-resistant surface coatings using machine learning
Le, Tu C, Penna, Matthew, Winkler, David A, Yarovsky, Irene
Published in Scientific reports (22.01.2019)
Published in Scientific reports (22.01.2019)
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Journal Article
Self-Organizing Map and Relational Perspective Mapping for the Accurate Visualization of High-Dimensional Hyperspectral Data
Gardner, Wil, Maliki, Ruqaya, Cutts, Suzanne M, Muir, Benjamin W, Ballabio, Davide, Winkler, David A, Pigram, Paul J
Published in Analytical chemistry (Washington) (04.08.2020)
Published in Analytical chemistry (Washington) (04.08.2020)
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Journal Article
Ultrafast Fabrication of Covalently Cross-linked Multifunctional Graphene Oxide Monoliths
Wan, Wubo, Li, Lingli, Zhao, Zongbin, Hu, Han, Hao, Xiaojuan, Winkler, David A., Xi, Lingcong, Hughes, Timothy C., Qiu, Jieshan
Published in Advanced functional materials (20.08.2014)
Published in Advanced functional materials (20.08.2014)
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Immune Modulation by Design: Using Topography to Control Human Monocyte Attachment and Macrophage Differentiation
Vassey, Matthew J., Figueredo, Grazziela P., Scurr, David J., Vasilevich, Aliaksei S., Vermeulen, Steven, Carlier, Aurélie, Luckett, Jeni, Beijer, Nick R. M., Williams, Paul, Winkler, David A., de Boer, Jan, Ghaemmaghami, Amir M., Alexander, Morgan R.
Published in Advanced science (01.06.2020)
Published in Advanced science (01.06.2020)
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