{ "info": { "author": "Calvin Peters", "author_email": "calvin.isotope@gmail.com", "bugtrack_url": null, "classifiers": [ "Operating System :: OS Independent", "Programming Language :: Python :: 3", "Topic :: Scientific/Engineering :: Artificial Intelligence", "Topic :: Scientific/Engineering :: Bio-Informatics", "Topic :: Scientific/Engineering :: Chemistry", "Topic :: Scientific/Engineering :: Mathematics", "Topic :: Scientific/Engineering :: Visualization" ], "description": "\n############\nIntroduction\n############\n\nmsAI - Software Tools to Create AI Models for Mass Spectrometry Data\n\n**Note:** msAI is in development. Currently, all releases are development previews. Features are incomplete and may change.\n\n\n********\nOverview\n********\n\n*msAI provides a library of python modules for...*\n\n* Extracting data from mass spectrometry data files\n\n * Supported MS file types: mzML, TBD\u2026\n\n* Importing sample metadata\n\n * Unify MS data and sample metadata in a single view\n\n* Partitioning data for training, testing, and validation\n\n* Quality analysis of MS runs / samples\n\n * Metadata verification\n * Anomaly detection\n\n* Plotting / visualization\n\n* AI / machine learning frameworks\n\n * TensorFlow\n * TBD\u2026\n\n* Creating AI models\n\n * Neural network architectures - neuron layers, connections, activation functions\n * Model training - loss and optimization functions, hyperparameter tuning\n * Evaluation of models - measure accuracy, prevent overfitting\n\n* Model lifecycle management\n\n * Deploy, update, backup, restore\n\n\n************\nInstallation\n************\n\nInstall from the Python Package Index (PyPI)::\n\n pip 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