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Generate various peak shapes

Package Exports

  • ml-peak-shape-generator
  • ml-peak-shape-generator/lib-esm/index.js
  • ml-peak-shape-generator/lib/index.js

This package does not declare an exports field, so the exports above have been automatically detected and optimized by JSPM instead. If any package subpath is missing, it is recommended to post an issue to the original package (ml-peak-shape-generator) to support the "exports" field. If that is not possible, create a JSPM override to customize the exports field for this package.

Readme

ml-peak-shape-generator

NPM version build status Test coverage npm download

Generate various peak shapes.

The current supported kinds of shapes:

Name Equation
Gaussian
Lorentzian
Pseudo Voigt

where

Installation

$ npm i ml-peak-shape-generator

This package allows to calculate various shapes. By default they will have a height of 1.

demo.png

You see the resulting functions using this playground

Usage

import {
  getGaussianData,
  getLorentzianData,
  getPseudoVoigtData,
} from 'ml-peak-shape-generator';

// It's possible to specify the windows size with factor option
let data = getGaussianData({ sd: 500 }, { factor: 3.5 });
// or fix the number of points as Full Width at Half Maximum
let data = getGaussianData({ fwhm: 500 }, { factor: 3.5 });

// It's possible to specify the windows size with factor option
let data = getLorentzianData({ fwhm: 500 }, { factor: 5 });

// It's possible to specify the windows size with factor option
let data = getPseudoVoigtData({ fwhm: 500 }, { factor: 5 });

It is also possible to take an instance of each kind of shape:

import { Gaussian, gaussianFct, Gaussian2D } from 'ml-peak-shape-shape';

const gaussianShape = new Gaussian({ fwhm: 500 });
// It is possible to set a new value for fwhm
gaussianShape.fwhm = 300;

// By default the height value ensure a volume equal 1.
const gaussian2DShape = new Gaussian2D({ fwhm: 500 });

// It is possible to set values for sd, fwhm and factor for each axes.
const gaussian2DShape = new Gaussian2D({ fwhm: { x: 300, y: 500 } });

// It is possible to set new value for fwhm by:
gaussian2D.fwhm = { x: 300, y: 500 };
// or set the same value for both axes.
gaussian2D.fwhm = 400;

//An instance of any shape has the same methods accessible for each
//shape e.g. fct or getData, but these use the internal parameters. e.g:

const gaussianShape = new Gaussian({ fwhm: 500 });
gaussianShape.fct(5);
gaussianFct(5, 500);
// getData
gaussianShape.getData({ factor: 3.5 });
import { getShape1D, getShape2D } from 'ml-peak-shape-generator';

// If you want to dynamically select a shape you can use the `getShapeGenerator` method. It returns a instance of required kind of shape.

let shapeGenerator = getShape1D({ kind: 'lorentzian', sd: 500 });
let shapeGenerator = getShape2D({ kind: 'gaussian', sd: 500 });

It is also possible to get a function that allows to calculate y for any x

import { gaussianFct } from 'ml-peak-shape-generator';
const func = gaussianFct(x - mean, fwhm);

API Documentation

License

MIT