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5 followers · 2 following

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Achievement: Pull Sharkx2Achievement: YOLOAchievement: QuickdrawAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pull Sharkx2Achievement: YOLOAchievement: QuickdrawAchievement: Arctic Code Vault Contributor

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mcnaughtonadm/README.md
  • 👋 Hi, I’m @mcnaughtonadm
  • 👀 I’m interested in the Scientific Application of Machine Learning and High Performance Scientific Simulations
  • 💼 I work at the University of California Riverside in the Ian Wheeldon Lab
  • 🌱 I’m currently learning Data Science in Python
  • 📫 How to reach me: mcnaughtonadm@gmail.com

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  1. adme-py adme-py Public

    Calculate ADME properties in python

    Python 1

  2. pnnl/cactus pnnl/cactus Public

    LLM Agent that leverages cheminformatics tools to provide informed responses.

    Jupyter Notebook 34 9

  3. PNNL-CompBio/3D_Scaffold PNNL-CompBio/3D_Scaffold Public

    Python 25 4

  4. PNNL-CompBio/ML_UVvisModels PNNL-CompBio/ML_UVvisModels Public

    Jupyter Notebook 13 1

  5. pnnl-predictive-phenomics/emll pnnl-predictive-phenomics/emll Public

    Jupyter Notebook 4 3

  6. PNNL-CompBio/CONCERTO PNNL-CompBio/CONCERTO Public

    Continuous integration and validation for genome-scale metabolic model consortia

    HTML 3 3