| Year |
Citation |
Score |
| 2024 |
Van Herck J, Gil MV, Jablonka KM, Abrudan A, Anker AS, Asgari M, Blaiszik B, Buffo A, Choudhury L, Corminboeuf C, Daglar H, Elahi AM, Foster IT, Garcia S, Garvin M, ... ... Moosavi SM, et al. Assessment of fine-tuned large language models for real-world chemistry and material science applications. Chemical Science. PMID 39664810 DOI: 10.1039/d4sc04401k |
0.481 |
|
| 2024 |
Charalambous C, Moubarak E, Schilling J, Sanchez Fernandez E, Wang JY, Herraiz L, Mcilwaine F, Peh SB, Garvin M, Jablonka KM, Moosavi SM, Van Herck J, Ozturk AY, Pourghaderi A, Song AY, et al. A holistic platform for accelerating sorbent-based carbon capture. Nature. PMID 39020168 DOI: 10.1038/s41586-024-07683-8 |
0.463 |
|
| 2023 |
Moubarak E, Moosavi SM, Charalambous C, Garcia S, Smit B. A Robust Framework for Generating Adsorption Isotherms to Screen Materials for Carbon Capture. Industrial & Engineering Chemistry Research. 62: 10252-10265. PMID 37425135 DOI: 10.1021/acs.iecr.3c01358 |
0.524 |
|
| 2023 |
Glasby LT, Gubsch K, Bence R, Oktavian R, Isoko K, Moosavi SM, Cordiner JL, Cole JC, Moghadam PZ. DigiMOF: A Database of Metal-Organic Framework Synthesis Information Generated via Text Mining. Chemistry of Materials : a Publication of the American Chemical Society. 35: 4510-4524. PMID 37332681 DOI: 10.1021/acs.chemmater.3c00788 |
0.455 |
|
| 2022 |
Domingues NP, Moosavi SM, Talirz L, Jablonka KM, Ireland CP, Ebrahim FM, Smit B. Using genetic algorithms to systematically improve the synthesis conditions of Al-PMOF. Communications Chemistry. 5: 170. PMID 36697847 DOI: 10.1038/s42004-022-00785-2 |
0.703 |
|
| 2022 |
Krenn M, Ai Q, Barthel S, Carson N, Frei A, Frey NC, Friederich P, Gaudin T, Gayle AA, Jablonka KM, Lameiro RF, Lemm D, Lo A, Moosavi SM, Nápoles-Duarte JM, et al. SELFIES and the future of molecular string representations. Patterns (New York, N.Y.). 3: 100588. PMID 36277819 DOI: 10.1016/j.patter.2022.100588 |
0.475 |
|
| 2022 |
Moosavi SM, Novotny BÁ, Ongari D, Moubarak E, Asgari M, Kadioglu Ö, Charalambous C, Ortega-Guerrero A, Farmahini AH, Sarkisov L, Garcia S, Noé F, Smit B. A data-science approach to predict the heat capacity of nanoporous materials. Nature Materials. PMID 36229651 DOI: 10.1038/s41563-022-01374-3 |
0.524 |
|
| 2021 |
Majumdar S, Moosavi SM, Jablonka KM, Ongari D, Smit B. Diversifying Databases of Metal Organic Frameworks for High-Throughput Computational Screening. Acs Applied Materials & Interfaces. PMID 34910455 DOI: 10.1021/acsami.1c16220 |
0.593 |
|
| 2021 |
Jablonka KM, Ongari D, Moosavi SM, Smit B. Using collective knowledge to assign oxidation states of metal cations in metal-organic frameworks. Nature Chemistry. PMID 34226703 DOI: 10.1038/s41557-021-00717-y |
0.506 |
|
| 2020 |
Jablonka KM, Moosavi SM, Asgari M, Ireland C, Patiny L, Smit B. A data-driven perspective on the colours of metal-organic frameworks. Chemical Science. 12: 3587-3598. PMID 34163632 DOI: 10.1039/d0sc05337f |
0.548 |
|
| 2020 |
Moosavi SM, Xu H, Chen L, Cooper AI, Smit B. Geometric landscapes for material discovery within energy-structure-function maps. Chemical Science. 11: 5423-5433. PMID 34094069 DOI: 10.1039/d0sc00049c |
0.523 |
|
| 2020 |
Moosavi SM, Jablonka KM, Smit B. The Role of Machine Learning in the Understanding and Design of Materials. Journal of the American Chemical Society. PMID 33170678 DOI: 10.1021/jacs.0c09105 |
0.501 |
|
| 2020 |
Maul J, Ongari D, Moosavi SM, Smit B, Erba A. Thermoelasticity of Flexible Organic Crystals from Quasi-harmonic Lattice Dynamics: The Case of Copper(II) Acetylacetonate. The Journal of Physical Chemistry Letters. 8543-8548. PMID 32969662 DOI: 10.1021/acs.jpclett.0c02762 |
0.457 |
|
| 2020 |
Moosavi SM, Nandy A, Jablonka KM, Ongari D, Janet JP, Boyd PG, Lee Y, Smit B, Kulik HJ. Understanding the diversity of the metal-organic framework ecosystem. Nature Communications. 11: 4068. PMID 32792486 DOI: 10.1038/S41467-020-17755-8 |
0.66 |
|
| 2020 |
Jablonka KM, Ongari D, Moosavi SM, Smit B. Big-Data Science in Porous Materials: Materials Genomics and Machine Learning. Chemical Reviews. PMID 32520531 DOI: 10.1021/Acs.Chemrev.0C00004 |
0.575 |
|
| 2019 |
Boyd PG, Chidambaram A, García-Díez E, Ireland CP, Daff TD, Bounds R, Gładysiak A, Schouwink P, Moosavi SM, Maroto-Valer MM, Reimer JA, Navarro JAR, Woo TK, Garcia S, Stylianou KC, et al. Data-driven design of metal-organic frameworks for wet flue gas CO capture. Nature. 576: 253-256. PMID 31827290 DOI: 10.1038/S41586-019-1798-7 |
0.582 |
|
| 2019 |
Peng L, Yang S, Jawahery S, Moosavi SM, Huckaba AJ, Asgari M, Oveisi E, Nazeeruddin MK, Smit B, Queen WL. Preserving Porosity of Mesoporous Metal-Organic Frameworks through the Introduction of Polymer Guests. Journal of the American Chemical Society. PMID 31318207 DOI: 10.1021/Jacs.9B05967 |
0.506 |
|
| 2019 |
Jawahery S, Rampal N, Moosavi SM, Witman M, Smit B. Ab Initio Flexible Force Field for Metal-Organic Frameworks Using Dummy Model Coordination Bonds. Journal of Chemical Theory and Computation. PMID 31082258 DOI: 10.1021/Acs.Jctc.9B00135 |
0.432 |
|
| 2019 |
Moosavi SM, Chidambaram A, Talirz L, Haranczyk M, Stylianou KC, Smit B. Capturing chemical intuition in synthesis of metal-organic frameworks. Nature Communications. 10: 539. PMID 30710082 DOI: 10.1038/S41467-019-08483-9 |
0.722 |
|
| 2018 |
Gładysiak A, Deeg KS, Dovgaliuk I, Chidambaram A, Ordiz K, Boyd PG, Moosavi SM, Ongari D, Navarro JAR, Smit B, Stylianou KC. A bi-porous metal-organic framework with tuneable CO2/CH4 separation performance facilitated by intrinsic flexibility. Acs Applied Materials & Interfaces. PMID 30247880 DOI: 10.1021/Acsami.8B13362 |
0.48 |
|
| 2018 |
Braun E, Lee Y, Moosavi SM, Barthel S, Mercado R, Baburin IA, Proserpio DM, Smit B. Generating carbon schwarzites via zeolite-templating. Proceedings of the National Academy of Sciences of the United States of America. PMID 30108146 DOI: 10.1073/Pnas.1805062115 |
0.652 |
|
| 2018 |
Braun E, Moosavi SM, Smit B. Anomalous effects of velocity rescaling algorithms: the flying ice cube effect revisited. Journal of Chemical Theory and Computation. PMID 30075070 DOI: 10.1021/Acs.Jctc.8B00446 |
0.364 |
|
| 2018 |
Moosavi SM, Boyd PG, Sarkisov L, Smit B. Improving the Mechanical Stability of Metal-Organic Frameworks Using Chemical Caryatids. Acs Central Science. 4: 832-839. PMID 30062111 DOI: 10.1021/Acscentsci.8B00157 |
0.53 |
|
| 2018 |
Lee Y, Barthel SD, Dlotko P, Moosavi SM, Hess K, Smit B. High-throughput screening approach for nanoporous materials genome using topological data analysis: application to zeolites. Journal of Chemical Theory and Computation. PMID 29986145 DOI: 10.1021/Acs.Jctc.8B00253 |
0.67 |
|
| 2016 |
Boyd PG, Moosavi SM, Witman M, Smit B. On the Force Field Prediction of Materials Properties in Metal Organic Frameworks. The Journal of Physical Chemistry Letters. PMID 28008758 DOI: 10.1021/Acs.Jpclett.6B02532 |
0.472 |
|
| Show low-probability matches. |