Unlocking the computational design of metal-organic cages von Tarzia, Andrew, Jelfs, Kim E

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Integrating Computational and Experimental Workflows for Accelerated Organic Materials Discovery von Greenaway, Rebecca L., Jelfs, Kim E.

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N -Aryl–linked spirocyclic polymers for membrane separations of complex hydrocarbon mixtures von Thompson, Kirstie A., Mathias, Ronita, Kim, Daeok, Kim, Jihoon, Rangnekar, Neel, Johnson, J. R., Hoy, Scott J., Bechis, Irene, Tarzia, Andrew, Jelfs, Kim E., McCool, Benjamin A., Livingston, Andrew G., Lively, Ryan P., Finn, M. G.

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Structurally Diverse Covalent Triazine-Based Framework Materials for Photocatalytic Hydrogen Evolution from Water von Meier, Christian B, Clowes, Rob, Berardo, Enrico, Jelfs, Kim E, Zwijnenburg, Martijn A, Sprick, Reiner Sebastian, Cooper, Andrew I

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Machine Learning for Organic Cage Property Prediction von Turcani, Lukas, Greenaway, Rebecca L, Jelfs, Kim E

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Hydrophilic microporous membranes for selective ion separation and flow-battery energy storage von Tan, Rui, Wang, Anqi, Malpass-Evans, Richard, Williams, Rhodri, Zhao, Evan Wenbo, Liu, Tao, Ye, Chunchun, Zhou, Xiaoqun, Darwich, Barbara Primera, Fan, Zhiyu, Turcani, Lukas, Jackson, Edward, Chen, Linjiang, Chong, Samantha Y., Li, Tao, Jelfs, Kim E., Cooper, Andrew I., Brandon, Nigel P., Grey, Clare P., McKeown, Neil B., Song, Qilei

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Streamlining the automated discovery of porous organic cages von Basford, Annabel R, Bennett, Steven K, Xiao, Muye, Turcani, Lukas, Allen, Jasmine, Jelfs, Kim. E, Greenaway, Rebecca L

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Coarse-grained modelling to predict the packing of porous organic cages von Wolpert, Emma H, Jelfs, Kim E

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Development of efficient aqueous organic redox flow batteries using ion-sieving sulfonated polymer membranes von Ye, Chunchun, Wang, Anqi, Breakwell, Charlotte, Tan, Rui, Grazia Bezzu, C., Hunter-Sellars, Elwin, Williams, Daryl R., Brandon, Nigel P., Klusener, Peter A. A., Kucernak, Anthony R., Jelfs, Kim E., McKeown, Neil B., Song, Qilei

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Porous Organic Cages for Sulfur Hexafluoride Separation von Hasell, Tom, Miklitz, Marcin, Stephenson, Andrew, Little, Marc A, Chong, Samantha Y, Clowes, Rob, Chen, Linjiang, Holden, Daniel, Tribello, Gareth A, Jelfs, Kim E, Cooper, Andrew I

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Molecular generation targeting desired electronic properties via deep generative models von Yuan, Qi, Santana-Bonilla, Alejandro, Zwijnenburg, Martijn A, Jelfs, Kim E

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Porous Organic Cage Nanocrystals by Solution Mixing von Hasell, Tom, Chong, Samantha Y, Jelfs, Kim E, Adams, Dave J, Cooper, Andrew I

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stk: An extendable Python framework for automated molecular and supramolecular structure assembly and discovery von Turcani, Lukas, Tarzia, Andrew, Szczypiński, Filip T., Jelfs, Kim E.

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Acid- and Base-Stable Porous Organic Cages: Shape Persistence and pH Stability via Post-synthetic “Tying” of a Flexible Amine Cage von Liu, Ming, Little, Marc A, Jelfs, Kim E, Jones, James T. A, Schmidtmann, Marc, Chong, Samantha Y, Hasell, Tom, Cooper, Andrew I

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Hierarchically Structure-Directing Effect of Multi-Ammonium Surfactants for the Generation of MFI Zeolite Nanosheets von Park, Woojin, Yu, Doae, Na, Kyungsu, Jelfs, Kim E, Slater, Ben, Sakamoto, Yasuhiro, Ryoo, Ryong

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Switching between Local and Global Aromaticity in a Conjugated Macrocycle for High‐Performance Organic Sodium‐Ion Battery Anodes von Eder, Simon, Yoo, Dong‐Joo, Nogala, Wojciech, Pletzer, Matthias, Santana Bonilla, Alejandro, White, Andrew J. P., Jelfs, Kim E., Heeney, Martin, Choi, Jang Wook, Glöcklhofer, Florian

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Mixed hierarchical local structure in a disordered metal–organic framework von Sapnik, Adam F., Bechis, Irene, Collins, Sean M., Johnstone, Duncan N., Divitini, Giorgio, Smith, Andrew J., Chater, Philip A., Addicoat, Matthew A., Johnson, Timothy, Keen, David A., Jelfs, Kim E., Bennett, Thomas D.

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From Concept to Crystals via Prediction: Multi‐Component Organic Cage Pots by Social Self‐Sorting von Greenaway, Rebecca L., Santolini, Valentina, Pulido, Angeles, Little, Marc A., Alston, Ben M., Briggs, Michael E., Day, Graeme M., Cooper, Andrew I., Jelfs, Kim E.

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Emergent Properties of an Organic Semiconductor Driven by its Molecular Chirality von Yang, Ying, Rice, Beth, Shi, Xingyuan, Brandt, Jochen R, Correa da Costa, Rosenildo, Hedley, Gordon J, Smilgies, Detlef-M, Frost, Jarvist M, Samuel, Ifor. D. W, Otero-de-la-Roza, Alberto, Johnson, Erin R, Jelfs, Kim E, Nelson, Jenny, Campbell, Alasdair J, Fuchter, Matthew J

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Modular and predictable assembly of porous organic molecular crystals von Jones, James T. A., Hasell, Tom, Wu, Xiaofeng, Bacsa, John, Jelfs, Kim E., Schmidtmann, Marc, Chong, Samantha Y., Adams, Dave J., Trewin, Abbie, Schiffman, Florian, Cora, Furio, Slater, Ben, Steiner, Alexander, Day, Graeme M., Cooper, Andrew I.

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