chemical-groups - npm Package Compare versions

Comparing version 1.2.2 to 1.3.0

package.json

		{
		"name": "chemical-groups",
		"version": "1.2.2",
		"version": "1.3.0",
		"description": "JSON containing information about chemical groups",
		"main": "lib/index.js",
		"module": "src/index.js",
		"main": "src/index.js",
		"files": [
		"src",
		"lib"
		"src"
		],
		@@ -21,4 +19,4 @@ "repository": {
		},
		"homepage": "https://github.com/cheminfo/mass-tools/tree/main/packages/chemical-elements#readme",
		"gitHead": "bd2c06e05f2196c5f9c6ff011cf3ef41e1b6a0f9"
		"homepage": "https://github.com/cheminfo/mass-tools/tree/master/packages/chemical-elements#readme",
		"gitHead": "ade929b07af4e2f0f8b3fe1aaf0df70c50f4b2db"
		}

src/__tests__/groups.test.js

		@@ -1,8 +0,11 @@
		import { groupsObject, groups } from '..';
		'use strict';

		let data = require('..');

		test('data size', () => {
		expect(groups.length).toBeGreaterThan(200);
		expect(data.groups.length).toBeGreaterThan(200);
		});

		test('groupsObject', () => {
		test('getGroupsObject', () => {
		let groupsObject = data.getGroupsObject();
		expect(groupsObject.Ala).toStrictEqual({
		@@ -9,0 +12,0 @@ elements: [

src/__tests__/groupsToSequence.test.js

		@@ -1,3 +0,5 @@
		import { groupsToSequence } from '..';
		'use strict';

		let groupsToSequence = require('../groupsToSequence');

		test('groupsToSequence', () => {
		@@ -4,0 +6,0 @@ expect(groupsToSequence('HOAlaGlyOH')).toBe('AG');

src/groupsObject.js

		@@ -1,4 +0,6 @@
		import { groups } from './groups';
		'use strict';

		export const groupsObject = {};
		const groups = require('./groups');

		const groupsObject = {};
		groups.forEach((e) => {
		@@ -10,1 +12,3 @@ if (groupsObject[e.symbol]) {
		});

		module.exports = groupsObject;

src/groupsToSequence.js

		@@ -1,9 +0,11 @@
		import { groupsObject } from './groupsObject.js';
		'use strict';

		const groupsObject = require('./groupsObject.js');

		/**
		* Recreate a one letter sequence
		* @param {object} mf
		* @param {} mf
		*/

		export function groupsToSequence(mf) {
		function groupsToSequence(mf) {
		mf = mf.replace(/$[^(]*$/g, '');
		@@ -26,1 +28,3 @@ let parts = mf.split(/(?=[A-Z ])/);
		}

		module.exports = groupsToSequence;

src/index.js

		@@ -1,3 +0,18 @@
		export * from './groups.js';
		export * from './groupsObject.js';
		export * from './groupsToSequence.js';
		'use strict';

		const groups = require('./groups.js');
		const groupsToSequence = require('./groupsToSequence');

		function getGroupsObject() {
		let object = {};
		groups.forEach((e) => {
		object[e.symbol] = e;
		});
		return object;
		}

		module.exports = {
		groups,
		getGroupsObject,
		groupsToSequence,
		};

lib/index.js

src/groups.js

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