Package Exports

ml-gsd
ml-gsd/src/gsd

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-gsd) to support the "exports" field. If that is not possible, create a JSPM override to customize the exports field for this package.

Readme

global-spectral-deconvolution

Global Spectra Deconvolution + Peak optimizer

Example

var CC = require('chemcalc');
var Stat = require('ml-stat');
var peakPicking = require("../src/index");


var spectrum=CC.analyseMF("Cl2.Br2", {isotopomers:'arrayXXYY', fwhm:0.01, gaussianWidth: 11});
var xy=spectrum.arrayXXYY;
var x=xy[0];
var y=xy[1];
//Just a fake noiseLevel
var noiseLevel=Stat.array.median(y.filter(function(a) {return (a>0)}))*3;

var result=peakPicking.gsd(x, y,  {noiseLevel: noiseLevel, minMaxRatio:0, broadRatio:0,smoothY:false});
result = peakPicking.optimize(result,x,y,1,"gaussian");`