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  2. List of mass spectrometry software - Wikipedia

    en.wikipedia.org/wiki/List_of_mass_spectrometry...

    Software by Bruker used with mass spectrometry instruments. DeNovoGUI Open source: The software has a graphical user interface for running parallelized versions of the freely available de novo sequencing software tools Novor and PepNovo+. [51] Easotope Open source: Easotope software archives, organizes, and analyzes mass spectrometer data.

  3. List of free geology software - Wikipedia

    en.wikipedia.org/wiki/List_of_free_geology_software

    This is a list of free and open-source software for geological data handling and interpretation. The list is split into broad categories, depending on the intended use of the software and its scope of functionality. Notice that 'free and open-source' requires that the source code is available and users are given a free software license.

  4. Fourier-transform infrared spectroscopy - Wikipedia

    en.wikipedia.org/wiki/Fourier-transform_infrared...

    Fourier transform infrared spectroscopy (FTIR) [1] is a technique used to obtain an infrared spectrum of absorption or emission of a solid, liquid, or gas. An FTIR spectrometer simultaneously collects high-resolution spectral data over a wide spectral range.

  5. OpenChrom - Wikipedia

    en.wikipedia.org/wiki/OpenChrom

    OpenChrom is an open source software for the analysis and visualization of mass spectrometric and chromatographic data. [4] Its focus is to handle native data files from several mass spectrometry systems (e.g. GC/MS, LC/MS, Py-GC/MS, HPLC-MS), vendors like Agilent Technologies, Varian, Shimadzu, Thermo Fisher, PerkinElmer and others.

  6. Spectral Database for Organic Compounds - Wikipedia

    en.wikipedia.org/wiki/Spectral_Database_for...

    The FT-IR spectra were recorded using a Nicolet 170SX or a JASCO FT/IR-410 spectrometer. For spectra recorded in the Nicolet spectrometer, the data were stored at intervals of 0.5 cm −1 in the 4,000 – 2,000 cm −1 region and of 0.25 cm −1 in the 2,000 – 400 cm −1 region and the spectral resolution was 0.25 cm −1.

  7. SPC file format - Wikipedia

    en.wikipedia.org/wiki/SPC_file_format

    They provide free tools and libraries to allow developers to create and maintain SPC files consistently. [4] This file format is not in plaintext, such as XML or CSV, but is a binary format and is therefore not readable with a standard text editor but requires a special reader or software to interpret the file data.

  8. Origin (data analysis software) - Wikipedia

    en.wikipedia.org/.../Origin_(data_analysis_software)

    Origin is a proprietary computer program for interactive scientific graphing and data analysis.It is produced by OriginLab Corporation, and runs on Microsoft Windows.It has inspired several platform-independent open-source clones and alternatives like LabPlot and SciDAVis.

  9. Two-dimensional infrared spectroscopy - Wikipedia

    en.wikipedia.org/wiki/Two-dimensional_infrared...

    There are two main approaches to two-dimensional spectroscopy, the Fourier-transform method, in which the data is collected in the time-domain and then Fourier-transformed to obtain a frequency-frequency 2D correlation spectrum, and the frequency domain approach in which all the data is collected directly in the frequency domain.