Thermo Scientific™ Compound Discoverer™ Software by Thermo Fisher Scientific

Manufacturer Thermo Fisher Scientific  |   Model: IQLAAEGABSFAOXMBDD  |  Available Worldwide
Compound Discoverer empowers researchers to strategically collect, organize, store and report data for both targeted and untargeted high resolution analyses. The software simplifies data processing with its ability to customize workflows, assemble data collected from multiple samples into one unified report, and integrate compound identification capabilities.


Thermo Scientific™ Compound Discoverer™ Software by Thermo Fisher Scientific product image
Thermo Scientific™ Compound Discoverer™ Software
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Extensive Toolset
Compound Discoverer software includes an extensive set of tools that can be used individually or in combination. The software offers the following features and benefits:

  • Untargeted compound detection with isotope and adduct grouping.
  • Unknown elemental composition based on high resolution information.
  • Database searching using mzCloud™, Chemspider, KEGG or your own databases.
  • Expected compound search, including dealkylation and dearylation predictions and transformation products.
  • Structure elucidation using FISh (fragment ion search).
  • Compound scoring based on matching natural or artificial pattern(s).
  • Interactive PCA and differential analysis.
  • Descriptive statistics.
  • Automatic background handling.
  • Multiple mass defect filtering.
  • Analog data support.

 

Workflow Flexibility to Match Analytical Requirements
Compound Discoverer software offers complete flexibility, yet makes it easy to assemble a workflow that matches the analytical requirements of your analysis.

  • Workflows are modular, assembled from a suite of advanced algorithms (nodes).
  • The drag-and-drop workflow editor makes it easy to assemble nodes into a complete workflow, allowing you to choose exactly how to process your data and in what sequence.

 

Configurable Data Display
Compound Discoverer software makes it easy to display the data that is most meaningful for your analyses in ways that also make that data more useful.

  • Customizable data display allows you to review only the data you choose.
  • Multiple monitor support ensures you can see the data you need all at once.
  • Powerful and flexible result table filtering with automatic background hiding.
  • Heat map-like tables for peak areas, ratios, log 2 fold change, CVs, p values and adjusted p-values.
  • Interactive PCA, volcano plot, ANOVA, box-whisker and trend line plot.
  • KEGG pathways: Global and context-specific.
  • The ability to stack or overlay orthogonal data increases confidence in conclusions.
  • Orthogonal approaches like pattern match and fragment trace combine with analog data to improve interpretation.
  • Visualization of spectral tree along with fragmentation annotations provides a pathway to structural elucidation.

 

Customizable Reports
Highly flexible, customizable reports in Compound Discoverer software make it possible to pass along the exact information needed in the exact format it is needed. Specifications, ​terms and pricing are subject to change. Not all products are available in all countries. Please consult your local sales representative for details.

Product Overview

Thermo Scientific™ Compound Discoverer™ Software by Thermo Fisher Scientific product image

Thermo Scientific™ Compound Discoverer™ Software

Manufacturer Thermo Fisher Scientific  |  Available Worldwide

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