Chemlib

Chemlib is a TypeScript library for simulating chemical processes. The software offers no visual frontend but instead should be used as a backend for other web applications.

Installation

1. Copy this repository using git clone
2. link the project using either npm link or npm install </path to Chemlib>

Dependencies

Chemlib utilizes the open source toolbox kekule.js, which should already be bundled with Chemlib.

Usage

Import

Simply import all components from Chemlib into another project using the common commands:

import * as chemlib from 'chemlib'

or just use individual components like so:

import {ElementData, Atom} from 'chemlib'

Components

Chemlib consists of multiple Classes, most of which need to work together to function properly. A list of all Classes with a short description can be found below.

| name | description | |--|--| | ElementData | A collection of data for each chemical element | | Atom | Representation of an atom | | Bond | Representation of an atomic bond | | Molecule | Representation of a molecule | | Mixture | A Representation of a mixture of one or more instances of Molecule | | StructureManager | Abstract static management class for Mixture} and Molecule objects | | ChemComponent | Representation of a chemical lab component such as beakers and flasks | | ComponentType | An enum for the specific component types, used for identification | | ElectricComponent | Representation of an electric component | | EComponentType | An enum for the specific electric component types, used for identification | | ComponentManager | Abstract static managing class for all components | | Simulation | A static abstract class used to access all chemical simulations |