Integrated Development Toolbox for Aquatic Chemical Model Generation

Toolbox for the experimental aquatic chemist, focused on acidification and CO2 air-water exchange. It contains all elements to model the pH, the related CO2 air-water exchange, and aquatic acid-base chemistry for an arbitrary marine, estuarine or freshwater system. It contains a suite of tools for sensitivity analysis, visualisation, modelling of chemical batches, and can be used to build dynamic models of aquatic systems. As from version 1.0-4, it also contains functions to calculate the buffer factors.


Reference manual

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1.0-4 by Karline Soetaert, 5 years ago

Browse source code at

Authors: Andreas F. Hofmann , Karline Soetaert , Filip J.R. Meysman , Mathilde Hagens

Documentation:   PDF Manual  

Task views: Chemometrics and Computational Physics

GPL (>= 2) license

Imports minpack.lm, graphics, grDevices, stats

Suggests deSolve

See at CRAN