World's Best Scientists 2026 revealed!
Digital Discovery
H-index 22

Digital Discovery

2635-098X

Published by: Royal Society of Chemistry

https://www.rsc.org/publishing/journals/digital-discovery

Ranking & Metrics

Discipline name Position Best Scientists Publications D-Index
Engineering and Technology 716 21 50 12

Additional Metrics

Number of Best Scientists*: 221
Documents by Best Scientists*: 262
Top 100 Ranked Scientists*: 13
SCIMAGO H-index: 20
SCIMAGO SJR: 1.246
Impact Factor: 5.6

Top Publications

  • Parallel tempered genetic algorithm guided by deep neural networks for inverse molecular design

    (2021)
    93 Citations
  • Graph Neural Networks for the prediction of infinite dilution activity coefficients

    (2022)
    55 Citations
  • A smile is all you need: predicting limiting activity coefficients from SMILES with natural language processing

    (2022)
    51 Citations
  • Accelerated chemical science with AI

    (2023)
    43 Citations
  • Group SELFIES: A Robust Fragment-Based Molecular String Representation

    (2022)
    26 Citations
  • Capturing molecular interactions in graph neural networks: a case study in multi-component phase equilibrium

    (2022)
    25 Citations
  • Calibration and generalizability of probabilistic models on low-data chemical datasets with DIONYSUS

    (2023)
    25 Citations
  • Generalizing property prediction of ionic liquids from limited labeled data: a one-stop framework empowered by transfer learning

    (2023)
    22 Citations
  • Orchestrating nimble experiments across interconnected labs

    (2023)
    20 Citations
  • Gibbs-Duhem-Informed Neural Networks for Binary Activity Coefficient Prediction

    (2023)
    16 Citations

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Best Scientists Contributing to This Journal