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19 Publications
2022 | Journal Article | IST-REx-ID: 11937 | 
Reinhardt, A., Bethkenhagen, M., Coppari, F., Millot, M., Hamel, S., & Cheng, B. (2022). Thermodynamics of high-pressure ice phases explored with atomistic simulations. Nature Communications. Springer Nature. https://doi.org/10.1038/s41467-022-32374-1
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| PubMed | Europe PMC
2022 | Journal Article | IST-REx-ID: 12128 |
Poelking, C., Faber, F. A., & Cheng, B. (2022). BenchML: An extensible pipelining framework for benchmarking representations of materials and molecules at scale. Machine Learning: Science and Technology. IOP Publishing. https://doi.org/10.1088/2632-2153/ac4d11
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2022 | Journal Article | IST-REx-ID: 12249 |
Cheng, B. (2022). Computing chemical potentials of solutions from structure factors. The Journal of Chemical Physics. AIP Publishing. https://doi.org/10.1063/5.0107059
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2022 | Journal Article | IST-REx-ID: 9695 |
Glielmo, A., Zeni, C., Cheng, B., Csanyi, G., & Laio, A. (2022). Ranking the information content of distance measures. PNAS Nexus. Oxford Academic. https://doi.org/10.1093/pnasnexus/pgac039
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