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Showing 16 open source projects for "gaussian"

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  • 1
    Jmol

    Jmol

    An interactive viewer for three-dimensional chemical structures.

    Over 1,000,000 page views per month. Jmol/JSmol is a molecular viewer for 3D chemical structures that runs in four independent modes: an HTML5-only web application utilizing jQuery, a Java applet, a stand-alone Java program (Jmol.jar), and a "headless" server-side component (JmolData.jar). Jmol can read many file types, including PDB, CIF, SDF, MOL, PyMOL PSE files, and Spartan files, as well as output from Gaussian, GAMESS, MOPAC, VASP, CRYSTAL, CASTEP, QuantumEspresso, VMD, and many other...
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    Downloads: 926 This Week
    Last Update:
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  • 2
    jfPaint

    jfPaint

    Multi-Tabbed and Multi-Layered Paint program with a rich tool set.

    Multi-Tabbed and Multi-Layered Paint program with a rich tool set. Features : pencil, line, curve, fill, box, circle, text, substitute, transparency, gradients and gaussian blur. Supports : JPG, PNG, BMP, TIFF, SVG, PGM, PPM, multi-layer proprietary file format (.jfpaint)
    Downloads: 4 This Week
    Last Update:
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  • 3
    VMS Draw

    VMS Draw

    user-friendly access to the latest computational spectroscopy tools

    VMS Draw provides general utilities (e.g. normalization, conversion, and other manipulations of several spectra at the same time) and a flexible graphical user interface (GUI) for an easy use by non-specialists which allows a seamless flow of information between experimentally and theoretically oriented researchers. Finally, it permits effective interactions with other electronic structure codes [e.g., nuclear magnetic resonance (NMR), microwave] even if Gaussian 16 offers the widest set...
    Downloads: 0 This Week
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  • 4

    jvqa

    Video Quality Assessment in Java

    ... by selecting image structure statistic (variance, gradient, shifted gradient, 2/3/4-component gradient of variance), structure scale (full, downsampled to 256 or multiscaled), pooling window type (Gaussian, Box, Box with downsampling, or unfiltered) and size, index stabilization (logical or by constants) and luminance index (Gaussian, Box, Box with downsampling or no luminance index).
    Downloads: 0 This Week
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  • 5
    EDM Calibration Baseline Fitting

    EDM Calibration Baseline Fitting

    EDMFit is an adjustment tool to estimate EDM calibration parameters.

    .... For uncertainties budgeting, EDMFit makes use of Monte-Carlo simulations and supports different distribution function: - Uniform distribution, - Triangular distribution and - Gaussian (normal) distribution. For refractive index determination, the application supports the following models: - Barrel and Sears (1939), - Edlen (1953, 1966), - Owens (1967), - IAG (1999) and - Ciddor (1996, 2002). The results of the adjustment are reported in a template-based and valid HTML5/CSS3 report.
    Downloads: 5 This Week
    Last Update:
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  • 6
    JIPT - Java Image Processing Toolkit
    This is an Image Processing toolkit written in Java. The source code is intended to help you understand processes such as Color Inversion, Edge Detection, Fourier Transform, Morphological process, Laplacian Sharpening, Gaussian Noise Adding, and hist
    Downloads: 2 This Week
    Last Update:
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  • 7

    Fast Matrix for Java

    General purpose matrix utilities for Java in Parallel Computing

    Fast Matrix for Java (fm4j) is a general-purpose matrix utility library for computing with dense matrices. fm4j encapsulated different underlying implementations and select the optimal one in run-time depending on the size of the input matrix. Moreover, fm4j employs Java (Tm) Concurrency to take advantage of the computation power of multi-cor processors.
    Downloads: 0 This Week
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  • 8
    JProGraM (PRObabilistic GRAphical Models in Java) is a statistical machine learning library. It supports statistical modeling and data analysis along three main directions: (1) probabilistic graphical models (Bayesian networks, Markov random fields, dependency networks, hybrid random fields); (2) parametric, semiparametric, and nonparametric density estimation (Gaussian models, nonparanormal estimators, Parzen windows, Nadaraya-Watson estimator); (3) generative models for random networks (small...
    Downloads: 1 This Week
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  • 9

    cognity

    A neural network library for Java.

    Cognity is an object-oriented neural network library for Java. It's goal is to provide easy-to-use, high level architecture for neural network computations along with reasonable performance.
    Downloads: 0 This Week
    Last Update:
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  • 10
    sigMan is a utility for the analysis of time-dependent signals, especially electropherogram/chromatogram data. It is no longer being actively updated or maintained by me (Nathan Cermak) as of January 2011, for lack of any users.
    Downloads: 0 This Week
    Last Update:
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  • 11
    FuzzyArithmetic
    Fuzzy numbers and basic fuzzy arithmetics (+, -, *, /, 1/x) implementation written in Java. Should be used as a library, but it also has a GUI which demonstrates its capabilities (using SWT widgets).
    Downloads: 0 This Week
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  • 12
    A utility for animating molecular vibrations. Normal modes are read from a file automatically determined to be from Aces2, Gamess, PC Gamess, Gaussian 90/92/95/94/98, ADF, Dalton, Jaguar, MOPAC, or Spartan.
    Downloads: 5 This Week
    Last Update:
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  • 13
    MolStart is a molecular structure viewer and editor in Java. MolStart reads xyz, PDB, tinker, car and Gaussian input files. MolStart also includes force field parameters for protein and DNA atomic typing to add Hydrogen atoms.
    Downloads: 0 This Week
    Last Update:
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  • 14
    Pattern recognition system written in Java. Provide statistical informations about satellite and medical imagery; and also recognize symbols in a gaussian blur.
    Downloads: 0 This Week
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  • 15
    OpenChem Workbench is an enterprise software suite designed for creating, saving, searching, and exchanging chemical data. It uses existing tools (NIST, Gaussian, CHEMKIN) and its own (easy molecule building, mechanism management, group additivity, etc.)
    Downloads: 0 This Week
    Last Update:
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  • 16
    A straight-forward Java implementation of a mixture model with pluggable mixture functions, e.g. a mixture of Gaussian functions. The number and dimensionality of the mixture functions is not limited. All critical calculations are performed in log-space.
    Downloads: 0 This Week
    Last Update:
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