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Jupyter Notebooks
Jupyter Notebooks
NOVICE
Getting Started
Getting Started
Introduction to OENotebook
Introduction to OENotebook
Visualizing Molecule Data
Visualizing Molecule Data
Finding Correlations
Finding Correlations
INTERMEDIATE
Plotting Molecules with 2D Depictions
Plotting Molecules with 2D Depictions
Doing and Depicting Substructure Searches
Doing and Depicting Substructure Searches
Using the Paired t-Test
Using the Paired t-Test
ADVANCED
Snowflake analysis of Virtual Screening Results
Snowflake analysis of Virtual Screening Results
Bayesian Query Comparison
Bayesian Query Comparison
Embedding Molecules
Embedding Molecules
Clustering Molecules with DBSCAN
Clustering Molecules with DBSCAN
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WHAT'S NEW?
Extremely Fast and Scalable Free Energy Calculations
OpenEye Scientific Announces Appointment of Dr. Giovanna Scapin to Board of Directors
Webinar: Update on multi-component CSP (Crystal Structure Prediction) at OpenEye
Searching at the Speed of Byte: Accelerating Similarity and Substructure Searches
