cheminfo/xps-analysis

Common package to deal with spectra

Ensure that we receive a text even if an ArrayBuffer is sent

js function for hashing messages with MD5

Global Spectra Deconvolution

Various utilities that extends openchemlib-js like HOSE codes or diastereotopic IDs

This plugin transforms ES2015 modules to CommonJS

TypeScript definitions for jest

CLI tool to build ChemInfo packages

Shared ESLint config for cheminfo and ml.js projects

Delightful JavaScript Testing.

Manipulate molecules

Fast and powerful CSV parser for the browser that supports web workers and streaming large files. Converts CSV to JSON and JSON to CSV.

generate a spectrum from discrete peaks

Vamas file format parser