Схожие документы

• Can machines learn density functionals? Past, present, and future of ML in DFT
  по: Akashi, Ryosuke, и др.
  Опубликовано: (2025)
• A Machine Learning and Explainable AI Framework Tailored for Unbalanced Experimental Catalyst Discovery
  по: Semnani, Parastoo, и др.
  Опубликовано: (2024)
• Machine learning classification of local environments in molecular crystals
  по: Kuroshima, Daisuke, и др.
  Опубликовано: (2024)
• On the design space between molecular mechanics and machine learning force fields
  по: Wang, Yuanqing, и др.
  Опубликовано: (2024)
• Geometric Deep Learning for Molecular Crystal Structure Prediction
  по: Kilgour, Michael, и др.
  Опубликовано: (2023)