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Yan, Yong ORCID: 0000-0002-7926-3959, Carrington, Elliot J, Petuya, Remi ORCID: 0000-0002-3118-6966, Whitehead, George FS, Verma, Ajay ORCID: 0000-0001-8085-7351, Hylton, Rebecca K, Tang, Chiu C, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003 et al (show 3 more authors) (2020) Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 142 (35). pp. 14903-14913.


Carrington, Elliot J ORCID: 0000-0001-8855-809X, Petuya, Remi ORCID: 0000-0002-3118-6966, Hylton, Rebecca K, Yan, Yong, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Berry, Neil G ORCID: 0000-0003-1928-0738, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2019) The Anisotropic Responses of a Flexible Metal-Organic Framework Constructed from Asymmetric Flexible Linkers and Heptanuclear Zinc Carboxylate Secondary Building Units. CRYSTAL GROWTH & DESIGN, 19 (10). pp. 5604-5618.


Kalidindi, Suresh B, Nayak, Sanjit, Briggs, Michael E ORCID: 0000-0003-1474-1267, Jansat, Susanna, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440, Miller, Gary J, Warren, John E, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Cora, Furio, Slater, Ben et al (show 3 more authors) (2015) Chemical and Structural Stability of Zirconium-based Metal-Organic Frameworks with Large Three-Dimensional Pores by Linker Engineering. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 54 (1). pp. 221-226.


Simpson, Jack (2023) Computational Prediction of Gel Properties. PhD thesis, University of Liverpool.


Antypov, Dmytro ORCID: 0000-0003-1893-7785, Deligkas, Argyrios, Gusev, Vladimir, Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483, Spirakis, Paul G ORCID: 0000-0001-5396-3749 and Theofilatos, Michail ORCID: 0000-0002-3699-0179 (2020) Crystal Structure Prediction via Oblivious Local Search. 18th Symposium on Experimental Algorithms (SEA 2020), 160. 21:1-21:14.


Antypov, Dmytro ORCID: 0000-0003-1893-7785, Shkurenko, Aleksander, Bhatt, Prashant M, Belmabkhout, Youssef, Adil, Karim, Cadiau, Amandine, Suyetin, Mikhail, Eddaoudi, Mohamed, Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 and Dyer, Matthew S ORCID: 0000-0002-4923-3003 (2020) Differential guest location by host dynamics enhances propylene/propane separation in a metal-organic framework. Nature Communications, 11 (1). 6099-.


Vasylenko, Andrij ORCID: 0000-0002-6933-0628, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gusev, Vladimir, Gaultois, Michael ORCID: 0000-0003-2172-2507, Dyer, Matthew ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew ORCID: 0000-0002-1910-2483 (2022) Element selection for functional materials discovery by integrated machine learning of atomic contributions to properties. [Preprint]


Vasylenko, Andrij ORCID: 0000-0002-6933-0628, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gusev, Vladimir V, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Dyer, Matthew S ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2023) Element selection for functional materials discovery by integrated machine learning of elemental contributions to properties. NPJ COMPUTATIONAL MATERIALS, 9 (1).


Katsoulidis, Alexandros ORCID: 0000-0003-0860-7440, Park, Kyo Sung, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Martí-Gastaldo, Calos, Miller, Gary, Warren, John, Robertson, Craig ORCID: 0000-0002-4789-7607, Blanc, Frederic, Darling, George ORCID: 0000-0001-9329-9993, Berry, Neil ORCID: 0000-0003-1928-0738 et al (show 3 more authors) (2014) Guest-Adaptable and Water-Stable Peptide-Based Porous Materials by Imidazolate Side Chain Control. Angewandte Chemie International Edition, 53 (1). pp. 193-198.


Tollitt, Adam M, Vismara, Rebecca, Daniels, Luke M ORCID: 0000-0002-7077-6125, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2021) High-Throughput Discovery of a Rhombohedral Twelve-Connected Zirconium-Based Metal-Organic Framework with Ordered Terephthalate and Fumarate Linkers. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 60 (52). pp. 26939-26946.


Pramudya, Yohanes, Bonakala, Satyanarayana, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Bhatt, Prashant M, Shkurenko, Aleksander, Eddaoudi, Mohamed, Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 and Dyer, Matthew S ORCID: 0000-0002-4923-3003 (2020) High-throughput screening of metal-organic frameworks for kinetic separation of propane and propene. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 22 (40). pp. 23073-23082.


Tollitt, Adam M ORCID: 0000-0001-9470-6095, Vismara, Rebecca ORCID: 0000-0001-9474-7671, Daniels, Luke M ORCID: 0000-0002-7077-6125, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2021) High‐Throughput Discovery of a Rhombohedral Twelve‐Connected Zirconium‐Based Metal‐Organic Framework with Ordered Terephthalate and Fumarate Linkers. Angewandte Chemie, 133 (52). pp. 27145-27152.


Petuya, Remi ORCID: 0000-0002-3118-6966, Durdy, Samantha, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440, Dyer, Matthew S ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2022) Machine-Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 61 (9). e202114573-.


Pétuya, Rémi ORCID: 0000-0002-3118-6966, Durdy, Samantha, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440, Dyer, Matthew S ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2022) Machine‐Learning Prediction of Metal–Organic Framework Guest Accessibility from Linker and Metal Chemistry. Angewandte Chemie, 134 (9).


Adamson, Duncan ORCID: 0000-0003-3343-2435, Gusev, Vladimir V, Deligkas, Argyrios, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Collins, Chritopher M ORCID: 0000-0002-0101-4426, Krysta, Piotr, Potapov, Igor, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Spirakis, Paul ORCID: 0000-0001-5396-3749 et al (show 1 more authors) (2023) Optimality Guarantees for Crystal Structure Prediction. Nature, 619 (7968). 68-+.


Navarro-Sanchez, Jose, Argente-Garcia, Ana I, Moliner-Martinez, Yolanda, Roca-Sanjuan, Daniel, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Campins-Falco, Pilar, Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 and Marti-Gastaldo, Carlos (2017) Peptide Metal-Organic Frameworks for Enantioselective Separation of Chiral Drugs. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 139 (12). pp. 4294-4297.


Zamaraeva, Elena, Collins, Christopher M ORCID: 0000-0002-0101-4426, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gusev, Vladimir V, Savani, Rahul ORCID: 0000-0003-1262-7831, Dyer, Matthew Stephen ORCID: 0000-0002-4923-3003, Darling, George ORCID: 0000-0001-9329-9993, Potapov, Igor, Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 and Spirakis, Paul G ORCID: 0000-0001-5396-3749 (2023) Reinforcement Learning in Crystal Structure Prediction. Digital Discovery, 2 (6). pp. 1831-1840.

This list was generated on Wed Feb 7 22:17:48 2024 GMT.