Development tools and libraries ******************************* devx - Development tools for fatdog64-701 (C/C++, fortran compiler, ..) jdk - Java Development Toolkit java version "1.7.0_65" Java(TM) SE Runtime Environment (build 1.7.0_65-b17) Java HotSpot(TM) 64-Bit Server VM (build 24.65-b04, mixed mode) Python 2 (#python) and Python 3 (#python3) Multiple libraries and development files Workflow management ******************* taverna - Java-based workflow management with additional functions (condition, iteration) OpenMS/TOPPAS - Framework for mass spectrometry data processing and GUI supported design of pipelines Data conversion and trimming **************************** ProteoWizard tools - MS data conversion and tools, see /usr/local/massypup64/proteowizard-tools.txt; without vendor libraries transpose - Transposing matrix data from commandline, sourcecode in /usr/local/bin/transpose.c. Currently compiled for maximum matrix size of 10,000 x 10,000 teapot/fteapot - Spreadsheet program supporting three dimensional data sets. The manual "teapot.pdf" is located in /usr/local/doc MS data processing suites ************************* MZmine - Java-based MS analysis program, focused on metabolomics OpenMS - MS data analysis programs, with TOPPView and TOPPAS (pipelines) Proteomics search engines and hit validation ******************************************** Comet - MS/MS peptide/protein search algorithm OMSSA - MS/MS peptide/protein search algorithm X!Tandem - MS/MS peptide/protein search algorithm TPP 4.8 - Trans-Proteomic-Pipeline R statistics language ********************* with MS data analysis related libraries, packages and scripts, e.g.: XCMS/metaXCMS - Metabolomics Metab.R - Statistical analysis of metabolomics results Rattle - Data Mining Compound identification *********************** massXpert - Analysis of polymer spectra SpiderMass - Target DB creation/ matching, Online searches and formula generation Mass Spectrometry Imaging (MSI) ******************************* HelloPhidget - Test tool for detection of connected Phidgets (prototyping of MSI) OpenMZxy - Control of Phidget imaging robot MSI.R - MSI analysis with R scripts Data visualization ****************** GGobi