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Isotope assisted discovery of metal chelating agents from LC-MS data
...The current version ChelomEx 1.2 from 06 January 2016 includes the following changes to the original version (ChelomEx 1.0):
- function to filter discovered isotope patterns after the first analysis step (isotope pattern search), accessible in the Isotope Pattern toolbar (v1.2)
- updates for compatibility with MatLab versions after 2014b (v1.2)
- siderophore database update (v1.1)
- can now also analyze negative mode data (v1.1)
- bug fixes (v1.1)
Moved to https://github.com/rdiankov/openrave
An open-source, cross-platform, plugin-based robot planning environment for autonomous robotics. Includes services like collision detection, physics, (inverse) kinematics, sensors, robot controls, python bindings, and a network scripting environment.
A Matlab toolbox for interfacing with the pure JAVA numerical library Snifflib. This toolbox provides convenience m-files for interoperability with Snifflib from within an active Matlab session running a JAVA virtual machine.
primeHandle is a set of data management tools in support of the PrIMe Initiative (http://primekinetics.org). primeHandle includes graphical user interfaces for searching through data collections, editing and submitting data to the PrIMe Data Depository.
JOELib/JOELib2 is a cheminformatics library which supports SMARTS substructure search, descriptor calculation, processing/filtering pipes, conversion of file formats, 100% pure Java, and interfaces to external programs (e.g. Ghemical) are available.
This tool allows to compute LOLIMOT models. LOLIMOT models are also called neuro-fuzzy models or fast neural network models. This tool can export the model into C, C++, Matlab.