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NanoHUB Jupyter Notebooks for Research and Education
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What is a Jupyter Notebook?
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Why Notebooks on nanoHUB?
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Education & Outreach
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CHM 372: Lattice Protein Simulator
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CHM 370: Physical Chemstry Lab Analysis and Visualization
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CHM 676: Graduate Molecular Spectroscopy
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Science Outreach: Protein Structure Lab
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Research Computing
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What limits widespread adoption of scientific software packages?
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Application Example: PigmentHunter
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Automated structure preparation
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Excitonic Simulations
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Demo: CHM372 Probability App
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Demo: Photosynthetic Protein Spectroscopy Lab
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Getting Started
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The Jupyter Notebook Tool
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The Jupyter Notebook Tool
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The Jupyter Notebook Tool
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Getting Started: Anatomy of a nanoHUB App
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Getting Started: Using GitHub
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Getting Started: Using GitHub
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Getting Started: Using GitHub
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Getting Started: Using GitHub
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Advanced: Front-end/Back-end Projects
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A word of caution: Data storage
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Conclusions
Description:
Explore the potential of nanoHUB Jupyter Notebooks for research and education in this 34-minute presentation by Prof. Michael Reppert from Purdue University. Learn about the advantages of using Jupyter Notebooks on nanoHUB for creating interactive applications in chemistry education. Discover various examples of notebooks developed for teaching chemistry, including a lattice protein simulator, probability app, and molecular spectroscopy tools. Gain insights into the benefits of using nanoHUB for research computing and overcoming limitations in scientific software adoption. Watch demonstrations of practical applications like the CHM372 Probability App and Photosynthetic Protein Spectroscopy Lab. Get guidance on getting started with nanoHUB Jupyter Notebooks, including tool usage, app anatomy, and GitHub integration. Understand advanced concepts like front-end/back-end projects and data storage considerations. This comprehensive overview provides valuable information for educators and researchers interested in leveraging Jupyter Notebooks for chemistry education and scientific computing on the nanoHUB platform. Read more

NanoHUB Jupyter Notebooks for Research and Education in Chemistry

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