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Hi, I’m Andrea Karlova

I am a research student at University Collage London.

I am interesting in designing molecular representations that can speed up development of new drugs and discovery of novel materials.

I hope that my work is a small step that can improve healthcare worldwide and help to mitigate the impact of the climate change.

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Education
  • ...
    University College London

    Computer Science

    PhD

  • ...
    Charles University in Prague, Faculty of Mathematics and Physics

    Mathematics

    Masters

Last updated 2020-11-20

My Publications

  1. SWUS: Active Learning with Structure Weighted Uncertainty Score
    Karlova, Andrea, and Paige, Brooks
    In Conference Workshop: Accessible and Efficient Foundation Models for Biological Discovery, ICML 2024 2024
  2. PEPSI: Post-docking Evaluation with Protein-Small Molecules Interactions,
    Karlova, Andrea, Dehaen, Wim, Penciu, Andrei, Dallaway, Richard, and Goonatilake, Suran
    In Conference Workshop: DGMs and Applications, NeurIPS 2021 2021
  3. How to Reward Your Drug Agent,
    Karlova, Andrea, Dehaen, Wim, and Penciu, Andrei
    In Conference Workshop: DGMs and Applications, NeurIPS 2021 2021
  4. Molecular Fingerprint VAE
    Karlova, Andrea, Dehaen, Wim, and Svozil, Daniel
    In Conference Workshop: Workshop on Computational Biology, ICML 2021 2021
  5. Virtual Screening for Perovskites Discovery
    Karlova, Andrea, Underwood, Cameron C.L., and Silva, Ravi
    In Conference Workshop: Workshop on Tackling Climate Change with Machine Learning, ICML 2021 2021
  6. Robustness of Latent Representations of Variational Autoencoders
    Karlova, Andrea
    In Conference Workshop: Workshop on Uncertainty and Robustness in Deep Learning, ICML 2020 2020
  7. On Beyond Black
    Karlová, Andrea, and Hagan, Patrick S.
    Wilmott 2016