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6 projects in result set.
0. QSAR Data Sets - Molecular descriptors and outcomes for several public domain data sets
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- Development Status : 4 - Beta [Filter]
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- Topic : Machine Learning : Model Selection and Validation [Filter]
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Registered: 2010-09-19 03:40 |
1. CHNOSZ - A package for thermodynamic modeling in geochemistry and biochemistry,
with functions for equilibrium activity diagrams and chemical affinities of reactions,
supported by an extensive thermodynamic database and group additivity for proteins.
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Registered: 2011-05-13 20:48 |
2. inspectr - Handling and analysis of Vis-NIR spectra, especially for soil science.
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- Development Status : 4 - Beta [Filter]
- Environment : Console (Text Based) [Filter]
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Registered: 2011-06-08 03:22 |
3. chemosensors - This package introduces a software tool that allows for the design of synthetic experiments in machine olfaction.
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Registered: 2012-01-19 14:28 |
4. Toolbox for chemoinformatics - Basic tools for chemoinformatics, including manipulations with chemical structures, reading/writing files, computing descriptors, building SAR/QSAR/QSPR models, predicting properties of chemical compounds, etc.
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- Development Status : 2 - Pre-Alpha [Filter]
- Environment : Console (Text Based) [Filter]
- Environment : Win32 (MS Windows) [Filter]
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Registered: 2012-10-01 20:42 |
5. seacarb - seacarb is an R package that calculates various parameters of the carbonate system in seawater. The package is available on CRAN and it is used in several large international programs like EUROTHROPH, CARBOOCEAN and EPOCA.
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- Development Status : 6 - Mature [Filter]
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Registered: 2008-12-24 09:50 |
