Imports: Rdisop, RColorBrewer, mixtools, BiocParallel, genefilter,
crosstalk, dplyr, plotly, broom, igraph, ggraph, ggplot2,

Suggests: knitr, testthat, xcms, MSnbase, plotly, shiny, rmarkdown, DT,
Imports: Rdisop, BiocParallel, grDevices, graphics, stats, utils,
methods, animation (>= 2.2.3), RColorBrewer, mixtools,

Title: Isotope pattern, profile and centroid calculation.
Description: 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

Title: Isotope pattern, profile and centroid calculation for mass
Description: 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.

Description: 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
Packaged: 2014-03-18 20:25:18 UTC; uchemadmin

Packaged: 2014-04-02 14:26:11 UTC; uchemadmin

Packaged: 2014-05-16 11:22:47 UTC; uchemadmin

Packaged: 2014-06-19 14:32:40 UTC; uchemadmin

Packaged: 2014-06-24 10:32:28 UTC; uchemadmin

Packaged: 2014-07-14 08:03:52 UTC; uchemadmin

Title: Isotope Pattern, Profile and Centroid Calculation for Mass
Packaged: 2015-06-04 21:31:37 UTC; uchemadmin

Packaged: 2016-03-14 14:52:36 UTC; uchemadmin

Packaged: 2016-09-27 21:12:40 UTC; uchemadmin

Loos, M., Gerber, C., Corona, F., Hollender, J., Singer, H. (2015)

Title: Peak picking for high resolution mass spectrometry data
Description: Sequential partitioning, clustering and peak detection of
centroided LC-MS mass spectrometry data (.mzXML). Interactive result and raw
Packaged: 2014-07-14 11:49:42 UTC; uchemadmin