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17 Publications
2022 | Journal Article | IST-REx-ID: 12128 | 
BenchML: An extensible pipelining framework for benchmarking representations of materials and molecules at scale
C. Poelking, F.A. Faber, B. Cheng, Machine Learning: Science and Technology 3 (2022).
[Published Version]
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C. Poelking, F.A. Faber, B. Cheng, Machine Learning: Science and Technology 3 (2022).
2022 | Journal Article | IST-REx-ID: 12249 |
Computing chemical potentials of solutions from structure factors
B. Cheng, The Journal of Chemical Physics 157 (2022).
[Published Version]
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B. Cheng, The Journal of Chemical Physics 157 (2022).