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wandering in chemical space
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wandering in chemical space
20 followers · 58 following

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AxelRolov/README.md

Alexey Orlov, PhD

AI × Chemistry • Research & Engineering

Twitter Follow GitHub followers GitHub stars Google Scholar

👋 Hi there

I’m Alexey Orlov (PhD). I work at the intersection of artificial intelligence and chemistry — building models and tools that help discover, understand, and design molecules and materials.

  • 🐦 Twitter/X: @AlexeyAOrlov
  • 🤝 Collabs: open to research/industry collaborations on AI for chemistry.

Popular repositories Loading

  1. CO2_chemical_solvents CO2_chemical_solvents Public

    Datasets, models and scripts related to the publication on the design of new amines for the effective CO2 absoprtion.

    Jupyter Notebook 6 1

  2. cdr_bench cdr_bench Public template

    Benchmarking Dimensionality Reduction Techniques on Chemical Datasets

    Jupyter Notebook 5 2

  3. crem crem Public

    Forked from DrrDom/crem

    CReM: chemically reasonable mutations framework

    Jupyter Notebook 1

  4. edesigner_core edesigner_core Public

    Forked from jamflcgh/edesigner_core

    Python 1

  5. ChemDist_paper ChemDist_paper Public

    Forked from DCoupry/ChemDist_paper

    Code and material necessary for the reproduction of the results in the paper "Application of deep metric learning to molecular similarity".

    TeX 1

  6. GeneticAlgorithmPython GeneticAlgorithmPython Public

    Forked from ahmedfgad/GeneticAlgorithmPython

    Source code of PyGAD, a Python 3 library for building the genetic algorithm and training machine learning algorithms (Keras & PyTorch).

    Python 1