Showing 395 open source projects for "x86_64-linux-gnu"

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  • 1
    This is the first force-matching software published with the ability to do general coarse-graining for molecular systems.
    Downloads: 0 This Week
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  • 2
    BINViz(Bidirectional Interactive Network Visualization) is a JavaScript library for network and graph visualization. The goal of this tool is to provide a better way to visualize complex graphical models and the underlying data in a web-based environ
    Downloads: 0 This Week
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  • 3
    CDL provides a generic C++ framework to write algorithms for the calculation of molecular descriptors. CDL provides efficient substructure search, fingerprints and pharmacophore algorithms, and many more for the calculation molecular descriptors.
    Downloads: 1 This Week
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  • 4
    A tool to convert mol or sdf files to SVG - scalable vector graphics. Sdf and mol files are files containing information about chemicals. The tool is written in PHP.
    Downloads: 0 This Week
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  • 5
    The JCAMP-DX project is the reference implemention of the IUPAC JCAMP-DX spectroscopy data standard.
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    Downloads: 1 This Week
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  • 6
    This project was inspired existing cheminformatics APIs such as the CDK, Marvin, and Frowns. The goal of the project is to produce a full featured cheminfo api for the .Net framework. Early stage dev will focus on data structures and classes for file io.
    Downloads: 0 This Week
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  • 7
    This project has moved. Please follow the WWW link below.
    Downloads: 0 This Week
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  • 8
    A Java-based tool to visualize, integrate and analyze LC-MS/MS proteomics data.
    Downloads: 0 This Week
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  • 9
    The ChemSense Studio software supports the creation and sharing of text, images, graphs, drawings, and storyboard animations of chemical processes. The ChemSense Animator can be run as a separate, stand-alone application. See http://chemsense.sri.com
    Downloads: 0 This Week
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  • 10
    Collection of scripts converting structure data files into different formats (e.g. CTRL to POSCAR).
    Downloads: 0 This Week
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  • 11
    The aim of the project is to provide open source collection of algorithms in the field of spectroscopy: data handling and processing, modeling and artificial intelligence tools.
    Downloads: 1 This Week
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  • 12
    This application transcribes basic codons and tells you the amino acid it codes for, the tRNA anti-Codon, and give you a 3D structural model of the amino acid and 2D picture of its chemical structure. Analysis reports can then be printed by the user.
    Downloads: 0 This Week
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  • 13
    Quantum Monte Carlo algorithms expressed in Python. This code calculates electronic properties of atoms and molecules from first principles.
    Downloads: 0 This Week
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  • 14
    It is a commandline tool to manipulate .xyz molecule files.
    Downloads: 0 This Week
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  • 15
    Chemical Calculator that can calculate various aspects of compounds. The programs main features are: * Get information about an element * Calculate the amount of moles of an element * Calculate the Empirical and Molecular formulas of a compound
    Downloads: 1 This Week
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  • 16
    QMcBeaver is an object-oriented program to perform Quantum Monte Carlo calculations on atoms and molecules. It is designed to be easy to modify, allowing new ideas to be quickly implemented.
    Downloads: 0 This Week
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  • 17
    Mdxvu is a C code program for Linux, Un*x and Win32/Cygwin. It analyses molecular structures and molecular dynamics (MD) trajectories from the AMBER, GROMACS, TINKER and DISCOVER (TM) programs. Simple graphics are provided by using the X11/XLIB library.
    Downloads: 0 This Week
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  • 18
    The software "SPCView" is used for XRF qualitative analysis of various substances with "SPECTROSCAN MAKC" spectrometers.
    Downloads: 0 This Week
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  • 19
    The CheckCML project is a collection of modules for the production and checking of chemical experimental data represented as CML. The core CheckCML library provides classes for the checking process; tools such as OscarData allow for the production of CML
    Downloads: 0 This Week
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  • 20
    PIMC++ is a code designed to perform fully-correlated simulations of quantum systems in continuous space at finite temperature using Path Integral Monte Carlo. It is designed in a modular way to facilitate easy addition of new algorithms.
    Downloads: 0 This Week
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  • 21
    An open source, free DIY biotech/biohacking bootstrapping kit. Genetic engineering/therapy, BioBricks, synthetic biology - schematics, tutorials, etc.
    Downloads: 0 This Week
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  • 22
    SonicData is a data collection and analysis program used in connection with a sound card voltage-to-frequency interface. Its intended use is for laboratory instrumentation.
    Downloads: 0 This Week
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  • 23
    This project going to develop a thermodinamical server for chemical simulation, equip design, scientific module for other aplication or chemical education. Also the thermo server is developed to complete the project of chemical simulation Sim42.Spanish
    Downloads: 1 This Week
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  • 24
    Janocchio is an application or applet for viewing 3D molecular structures and calculating NMR couplings and NOEs
    Downloads: 1 This Week
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  • 25
    GVIB is a user friendly package for vibrational analysis. Given a molecular geometry, it will calculate vibrational frequencies and intensities using anharmonic internuclear potential.
    Downloads: 0 This Week
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