Functions and data sets to support chemical thermodynamic modeling in biochemistry and low-temperature geochemistry. The features include calculation of the standard molal thermodynamic properties and chemical affinities of reactions involving minerals and/or biomolecules; a database of thermodynamic properties of aqueous, crystalline and gaseous species; amino acid group additivity for the standard molal thermodynamic properties of neutral and ionized proteins; use of the revised Helgeson-Kirkham-Flowers equations of state for aqueous species; construction of equilibrium activity diagrams as a function of temperature, pressure, and chemical activities or fugacities of basis species.

Maintainer: Jeffrey Dick <j3ffdick at gmail.com>

Author(s): Jeffrey Dick

Install package and any missing dependencies by running this line in your R console:

install.packages("CHNOSZ")

Depends R (>= 3.1.0)
Imports grDevices, graphics, stats, utils
Suggests limSolve, testthat, knitr
Enhances
Linking to
Reverse
depends
Reverse
imports
ecipex
Reverse
suggests
Reverse
enhances
Reverse
linking to

Package CHNOSZ
Materials
URL http://www.chnosz.net/ http://chnosz.r-forge.r-project.org/
Task Views ChemPhys
Version 1.0.8
Published 2016-05-28
License GPL (>= 2)
BugReports
SystemRequirements
NeedsCompilation yes
Citation
CRAN checks CHNOSZ check results
Package source CHNOSZ_1.0.8.tar.gz