[aut, cre],
R Core Team [ctb] (code derived from R's pmax())An integrated set of tools for thermodynamic calculations in geochemistry and compositional biology. Thermodynamic properties are taken from a database for minerals and inorganic and organic aqueous species including biomolecules, or from amino acid group additivity for proteins. High-temperature properties are calculated using the revised Helgeson-Kirkham-Flowers equations of state for aqueous species, and activity coefficients can be calculated for specified ionic strength. Functions are provided to define a system using basis species, automatically balance reactions, calculate the chemical affinities of formation reactions for selected species, calculate equilibrium activities, and plot the results on chemical activity diagrams.
| Version: | 1.1.3 |
| Depends: | R (≥ 3.1.0) |
| Imports: | grDevices, graphics, stats, utils |
| Suggests: | limSolve, testthat, knitr, rmarkdown, tufte, RSVGTipsDevice |
| Published: | 2017-11-13 |
| Author: | Jeffrey Dick [aut, cre],
R Core Team [ctb] (code derived from R's pmax()) |
| Maintainer: | Jeffrey Dick <j3ffdick at gmail.com> |
| License: | GPL-2 | GPL-3 [expanded from: GPL (≥ 2)] |
| URL: | http://www.chnosz.net/, http://chnosz.r-forge.r-project.org/ |
| NeedsCompilation: | yes |
| Citation: | CHNOSZ citation info |
| Materials: | NEWS |
| In views: | ChemPhys |
| CRAN checks: | CHNOSZ results |
| Reference manual: | CHNOSZ.pdf |
| Vignettes: |
An Introduction to CHNOSZ Regressing thermodynamic data Thermodynamic data in CHNOSZ Equilibrium in CHNOSZ Hot-spring proteins in CHNOSZ Winding journey down (in Gibbs energy) |
| Package source: | CHNOSZ_1.1.3.tar.gz |
| Windows binaries: | r-devel: CHNOSZ_1.1.3.zip, r-release: CHNOSZ_1.1.3.zip, r-oldrel: CHNOSZ_1.1.3.zip |
| OS X El Capitan binaries: | r-release: CHNOSZ_1.1.3.tgz |
| OS X Mavericks binaries: | r-oldrel: CHNOSZ_1.1.3.tgz |
| Old sources: | CHNOSZ archive |
| Reverse imports: | canprot, ecipex |
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