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Articles Citing

Deep Generative Modeling of the Canonical Ensemble with Differentiable Thermal Properties

Shuo-Hui Li1,*,†, Yao-Wen Zhang1,†, and Ding Pan1,2,‡

  • *Contact author: shuohuili@ust.hk
  • †These authors contributed equally to this work.
  • ‡Contact author: dingpan@ust.hk

Decoding high-temperature activity coefficients in magnesium alloys through interpretable data-driven thermodynamics

Xiwei Zhou, Yuan Yuan, Yanan Chen, Liang Wu, Ligang Zhang, Tingting Liu, Xianhua Chen, Nele Moelans, and Fusheng Pan

Materials Today Chemistry 57 104046 (2026)

Generalizable Protein Folding Pathway Exploration with DA2-GRASP: Extending Beyond Miniproteins

Yanbing Wen and Hao Dong

Journal of Chemical Theory and Computation 22 10977 (2026)

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