cheminfo

cheminfo/chromatography

Tools for storing, search and analyze GC/MS spectra

JavaScript
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MIT License
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Support the dependencies of cheminfo/chromatography

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Check if a value is any kind of array
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Calculate the isotopic distribution of a molecular formula
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Parse a molecular formula
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Get the maximum value in an array
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Get the average value in an array
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Global Spectra Deconvolution
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Matrix manipulation and computation library
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Principal component analysis
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Polynomial Regression
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Various method to process spectra
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Parse a text-file and convert it to an array of XY points
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This plugin transforms ES2015 modules to CommonJS
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TypeScript definitions for jest
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V8 coverage provider for Vitest
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CLI tool to build ChemInfo packages
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Convert strings into JCAMP
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Shared ESLint config for cheminfo and ml.js projects
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Extend jest to assert arrays with approximate values
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generate a spectrum from discrete peaks
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TypeScript is a language for application scale JavaScript development
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tiny binary search function with comparators
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Generate molecular formula based on a range and filters
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Baseline correction using adaptive iteratively reweighted penalized least
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Get the average value in an array
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Get the median value in an array
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non-negative Generalized Morphological Component Analysis
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Read and explore mzData v1.05 files
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Parser from NetCDF files to JSON usable for GC/MS

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