Charge state calculator

Tool for calculating the charge state of a molecule in a solution with a certain pH
78 Downloads
Updated Tue, 29 Mar 2016 19:53:39 +0000

View License

File name : 'charge.m'. This file can be used
for calculating the charge state of a certain molecule
in a solution with a certain pH in the pH range of
0 - 14
Three input values : 'pH', 'pKa' and 'type'
One ouput value : 'c'
pH: pH of the solution
pKa: pKa of the molecule
type: Choose 'basic' in case of a basic group
Choose 'acidic' in case of an acidic group
c: Charge state of the molecule

Input syntax : c(pH,pKa,'type')

Developed by Joris Meurs BASc (2016)

Cite As

Joris Meurs (2024). Charge state calculator (https://www.mathworks.com/matlabcentral/fileexchange/55403-charge-state-calculator), MATLAB Central File Exchange. Retrieved .

MATLAB Release Compatibility
Created with R2014b
Compatible with any release
Platform Compatibility
Windows macOS Linux
Categories
Find more on Chemistry in Help Center and MATLAB Answers

Community Treasure Hunt

Find the treasures in MATLAB Central and discover how the community can help you!

Start Hunting!
Version Published Release Notes
2.0.0.0

Issues on calculations resolved

1.0.0.0