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RESEARCH PAPER · Molecular Systems Design & Engineering · 2018

Understanding structural adaptability: a reactant informatics approach to experiment design

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12 direct citing papers in this saved network. Explore the next layer with second-order citations.

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42 direct citing works

Understanding structural adaptability: a reactant informatics approach to experiment designOriginalDesign of multifunctional supercapacitor electrodes using an informatics approach27Experiment Specification, Capture and Laboratory Automation Technology (ESCALATE): a software pipeline for automated chemical experimentation and data management73Semi-supervised machine-learning classification of materials synthesis procedures150Autonome Entdeckung in den chemischen Wissenschaften, Teil I: Fortschritt12Autonomous Discovery in the Chemical Sciences Part I: Progress316Twenty years of exceptional success: The molecular education and research consortium in undergraduate computational chemistry ( MERCURY )29Robot-Accelerated Perovskite Investigation and Discovery187Predicting inorganic dimensionality in templated metal oxides8Text Mining for Energy Materials3Molecular design for perovskite solar cells5How to accelerate the inorganic materials synthesis: from computational guidelines to data-driven method?9Is Automated Discovery Expanding Human Understanding? On the Role of Machine Learning in the Increase of Scientific Understanding1

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  1. Design of multifunctional supercapacitor electrodes using an informatics approach

    Molecular Systems Design & Engineering · 2019-01-01

    Anish G. Patel, Luke Johnson, Raymundo Arróyave, Jodie L. Lutkenhaus

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  2. Experiment Specification, Capture and Laboratory Automation Technology (ESCALATE): a software pipeline for automated chemical experimentation and data management

    MRS Communications · 2019-06-04

    Ian M. Pendleton, Gary Cattabriga, Zhi Li, Mansoor Ani Najeeb, Sorelle A. Friedler, Alexander J. Norquist, Emory M. Chan, Joshua Schrier

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  3. Semi-supervised machine-learning classification of materials synthesis procedures

    npj Computational Materials · 2019-07-08

    Haoyan Huo, Ziqin Rong, Olga Kononova, Wenhao Q. Sun, Tiago Botari, Tanjin He, Vahe Tshitoyan, Gerbrand Ceder

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  4. Autonome Entdeckung in den chemischen Wissenschaften, Teil I: Fortschritt

    Angewandte Chemie · 2019-09-25

    Connor W. Coley, Natalie S. Eyke, Klavs F. Jensen

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  5. Autonomous Discovery in the Chemical Sciences Part I: Progress

    Angewandte Chemie International Edition · 2019-09-25

    Connor W. Coley, Natalie S. Eyke, Klavs F. Jensen

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  6. Twenty years of exceptional success: The molecular education and research consortium in undergraduate computational chemistry ( MERCURY )

    International Journal of Quantum Chemistry · 2020-06-01

    George C. Shields

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  7. Robot-Accelerated Perovskite Investigation and Discovery

    Chemistry of Materials · 2020-06-04

    Zhi Li, Mansoor Ani Najeeb, Liana Alves, Alyssa Sherman, Venkateswaran Shekar, Peter L. Cruz Parrilla, Ian M. Pendleton, Wesley Wang, Philip W. Nega, Mat­thias Zeller, Joshua Schrier, Alexander J. Norquist, Emory M. Chan

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  8. Predicting inorganic dimensionality in templated metal oxides

    The Journal of Chemical Physics · 2021-05-12

    Qianxiang Ai, Davion Marquise Williams, Matthew Danielson, Liam G. Spooner, Joshua A. Engler, Zihui Ding, Mat­thias Zeller, Alexander J. Norquist, Joshua Schrier

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  9. Text Mining for Energy Materials

    Journal of Research in Science and Engineering · 2022-03-31

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  10. Molecular design for perovskite solar cells

    International Journal of Energy Research · 2022-06-27

    Lei Zhang, Wenguang Hu

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  11. How to accelerate the inorganic materials synthesis: from computational guidelines to data-driven method?

    National Science Review · 2025-02-27

    Yilei Wu, Xiangyang Li, Rong Guo, Rui Xu, Ming‐Gang Ju, Jinlan Wang

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  12. Is Automated Discovery Expanding Human Understanding? On the Role of Machine Learning in the Increase of Scientific Understanding

    Journal for General Philosophy of Science · 2025-08-07

    Kristian González Barman

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