Fast and very memory-efficient calculation of isotope patterns, subsequent convolution to theoretical envelopes (profiles) plus valley detection and centroidization or intensoid calculation. Batch processing, resolution interpolation, wrapper, adduct calculations and molecular formula parsing.
| Version: | 2.2 |
| Published: | 2016-10-02 |
| Author: | Martin Loos, Christian Gerber |
| Maintainer: | Martin Loos <mloos at looscomputing.ch> |
| License: | GPL-2 |
| URL: | http://www.envipat.eawag.ch/, http://pubs.acs.org/doi/abs/10.1021/acs.analchem.5b00941 |
| NeedsCompilation: | yes |
| Citation: | enviPat citation info |
| Materials: | NEWS |
| CRAN checks: | enviPat results |
| Reference manual: | enviPat.pdf |
| Package source: | enviPat_2.2.tar.gz |
| Windows binaries: | r-devel: enviPat_2.2.zip, r-release: enviPat_2.2.zip, r-oldrel: enviPat_2.2.zip |
| OS X El Capitan binaries: | r-release: enviPat_2.2.tgz |
| OS X Mavericks binaries: | r-oldrel: enviPat_2.2.tgz |
| Old sources: | enviPat archive |
| Reverse depends: | nontarget |
| Reverse imports: | InterpretMSSpectrum |
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