KinESim
KinESim: Pre-equilibrium kinetic simulation of electrochemical reactions - Published in JOSS (2019)
Science Score: 93.0%
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Published in Journal of Open Source Software
Repository
Igor Pro package for simulation of homogeneous and heterogeneous electrochemical reactions
Basic Info
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Metadata Files
readme.md
KinESim
Igor Pro package and examples for simulation of homogeneous and heterogeneous electrochemical reactions
Important: This software requires Igor v. 8.0 to run.
Kin-E-Sim is a package for Igor Pro designed to predict the characteristic response of an analyte in various electrochemical methods, including normal pulsed voltammetry (illustrated below), cyclic voltammetry, etc. This document is intended to provide a new user the information they need to begin using the Kin-E-Sim program. See citation for further details on the implemented algorithms.
Installation
Clone the git repository and open the KES/KinESim.ipf in IgorPro. The necessary dependencies are included and are loaded by KinESim.ipf. See API for more details of file structure.
Using KinESim
A manual is provided that includes instructions for installation, a tutorial featuring demo simulations, and a complete description of the KinESim control panel.
A demo of Kin-E-Sim containing pre-loaded simulations is available here.
A performance test is provided here.
An API can be found here.
Community Guidelines
Bug reports and requests for improvements, and new features are welcomed! Please feel free to make a post to Biospec Github Issue Tracker or contact Denis A. Proshlyakov, dapro@chemistry.msu.edu
Owner
- Login: dap-biospec
- Kind: user
- Repositories: 1
- Profile: https://github.com/dap-biospec
JOSS Publication
KinESim: Pre-equilibrium kinetic simulation of electrochemical reactions
Authors
Department of Chemistry, Michigan State University
Department of Chemistry, Michigan State University
Editor
Kyle Niemeyer
Tags
Igor Pro chemistry kinetics homogeneous heterogeneous equilibrium electrodeGitHub Events
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