2023

Modular, multi-robot integration of laboratories: an autonomous workflow for solid-state chemistry

Amy M Lunt, Hatem Fakhruldeen, Gabriella Pizzuto, Louis Longley, Alexander White, Nicola Rankin, Rob Clowes, Ben Alston, Lucia Gigli, Graeme M Day, Andrew I Cooper, Samantha Y Chong

Chem. Sci., 2024, 15, 2456, https://doi.org/10.1039/D3SC06206F

 

Machine Learning Accelerated Exploration of Ternary Organic Heterojunction Photocatalysts for Sacrificial Hydrogen Evolution

H Yang, Y Che, AI Cooper, L Chen, X Li

 J. Am. Chem. Soc., 2023, 145 (49), 27038, https://doi.org/10.1021/jacs.3c10586

 

Domain Knowledge Injection in Bayesian Search for New Materials

Z Xie, X Evangelopoulos, J Thacker, A Cooper

arXiv preprint arXiv:2311.15162, https://doi.org/10.3233/FAIA230587

 

Go with the flow: deep learning methods for autonomous viscosity estimations

M Walker, G Pizzuto, H Fakhruldeen, AI Cooper

Digital Discovery,2023, 2 (5), 1540https://doi.org/10.1039/D3DD00109A

 

Soft Hydrogen-Bonded Organic Frameworks Constructed Using a Flexible Organic Cage Hinge

Qiang Zhu, Lei Wei, Chengxi Zhao, Hang Qu, Bowen Liu, Thomas Fellowes, Siyuan Yang, Alexandra Longcake, Michael J. Hall, Michael R. Probert, Yingbo Zhao, Andrew I. Cooper*, and Marc A. Little*

J. Am. Chem. Soc., 2023, https://doi.org/10.1021/jacs.3c09246

 

Powder-Bot: A Modular Autonomous Multi-Robot Workflow for Powder X-Ray Diffraction

Amy M. Lunt, Hatem Fakhruldeen, Gabriella Pizzuto, Louis Longley, Alexander White, Nicola Rankin, Rob Clowes, Ben M. Alston, Andrew I. Cooper, Samantha Y. Chong

arXiv preprint arXiv:2309.00544, https://doi.org/10.48550/arXiv.2309.00544

 

Controlling the Crystallisation and Hydration State of Crystalline Porous Organic Salts

Megan O'Shaughnessy, Alex C. Padgham, Rob Clowes,  Marc A. Little, Michael C. Brand, Hang Qu, Anna G. Slater,  Andrew I. Cooper

Chemistry–A European Journal, 2023, e202302420

 

Fine-tuning GPT-3 for machine learning electronic and functional properties of organic molecules

Zikai Xie, Xenophon Evangelopoulos, Ömer Omar, Alessandro Troisi, Andrew I. Cooper, Linjiang Chen

ChemRxiv preprint,  https://doi.org/10.26434/chemrxiv-2023-h02j4

 

HypBO: Expert-Guided Chemist-in-the-Loop Bayesian Search for New Materials

Abdoulatif Cisse, Xenophon Evangelopoulos, Sam Carruthers, Vladimir V. Gusev, Andrew I. Cooper

arXiv preprint arXiv:2308.11787, https://doi.org/10.48550/arXiv.2308.11787

 

Leveraging Multi-modal Sensing for Robotic Insertion Tasks in R&D Laboratories

Aaron Butterworth, Gabriella Pizzuto, Leszek Pecyna, Andrew I Cooper, Shan Luo

arXiv preprint arXiv:2307.00671, https://doi.org/10.48550/arXiv.2307.00671

 

Fluorinated covalent organic frameworks coupled with molecular cobalt cocatalysts for efficient photocatalytic CO2 reduction

Zhiwei Fu, Chang Shu, Xiaoyan Wang, Linjiang Chen, Xue Wang, Lunjie Liu, Kewei Wang, Rob Clowes, Samantha Y Chong, Xiaofeng Wu, Andrew I Cooper,

CSC Chemistry, 2023, https://doi.org/10.31635/ccschem.023.202202688

 

Experimental Confirmation of a Predicted Porous HydrogenBonded Organic Framework

Caitlin E Shields, Xue Wang, Thomas Fellowes, Rob Clowes, Linjiang Chen, Graeme M Day, Anna G Slater, John W Ward, Marc A Little, Andrew I Cooper

Chem.Int., 2023, 62, e202303167, https://doi.org/10.1002/anie.202303167

 

Packing-induced selectivity switching in molecular nanoparticle photocatalysts for hydrogen and hydrogen peroxide production

Haofan Yang, Chao Li, Tao Liu, Thomas Fellowes, Samantha Y Chong, Luca Catalano, Mounib Bahri, Weiwei Zhang, Yongjie Xu, Lunjie Liu, Wei Zhao, Adrian M Gardner, Rob Clowes, Nigel D Browning, Xiaobo Li, Alexander J Cowan, Andrew I Cooper

Nature Nanotechnology, 2023, 18 (3), 307, https://doi.org/10.1038/s41565-022-01289-9

 

Photoresponsive Type III Porous Liquids

Michael C Brand, Nicola Rankin, Andrew I Cooper, Rebecca L Greenaway

Chemistry–A European Journal, 2023, 29 (4), e202202848, https://doi.org/10.1002/chem.202202848

 

Making the connections: Physical and electric interactions in biohybrid photosynthetic systems

Ying Yang, Luning Liu, Haining Tian, Andrew Cooper, Reiner Sebastian Sprick

Energy Environ. Sci., 2023, https://doi.org/10.1039/D3EE01265D

 

Autonomous Biomimetic Solid Dispensing Using a Dual-Arm Robotic Manipulator

Ying Jiang, Hatem Fakhruldeen, Gabriella Pizzuto, Louis Longley, Ai He, Tianwei Dai, Rob Clowes, Nicola Rankin, Andrew Cooper

Digital Discovery, 2023, https://doi.org/10.1039/D3DD00075C

 

Synthetic engineering of a new biocatalyst encapsulating [NiFe]-hydrogenases for enhanced hydrogen production

Qiuyao Jiang, Tianpei Li, Jing Yang, Catherine M Aitchison, Jiafeng Huang, Yu Chen, Fang Huang, Qiang Wang, Andrew I Cooper, Lu-Ning Liu

JMater. Chem. B, 2023, 11, 2684, https://doi.org/10.1039/D2TB02781J

 

 

Investigating the factors that influence sacrificial hydrogen evolution activity for three structurally-related molecular photocatalysts: thermodynamic driving force, excited-state dynamics, and surface interaction with cocatalysts

Tao Liu, Linjiang Chen, Xiaobo Li, Andrew I Coope

Phys. Chem. Chem. Phys., 2023, 25, 3494, https://doi.org/10.1039/D2CP04039E

  

Competitive aminal formation during the synthesis of a highly soluble, isopropyl-decorated imine porous organic cage

Rachel J Kearsey, Andrew Tarzia, Marc A Little, Michael C Brand, Rob Clowes, Kim E Jelfs, Andrew I Cooper, Rebecca L Greenaway

Chem. Commun., 2023, 59, 3731, https://doi.org/10.1039/D3CC00072A