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Showing 10 open source projects for "numerical simulation software"

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  • 1
    DWSIM - Open Source Process Simulator

    DWSIM - Open Source Process Simulator

    Simulate chemical processes using advanced thermodynamic models

    DWSIM is an open source, CAPE-OPEN compliant chemical process simulator for Windows, Linux and macOS systems. Written in VB.NET and C#, DWSIM features a comprehensive set of unit operations, advanced thermodynamic models, support for reacting systems, petroleum characterization tools and a fully-featured graphical interface. DWSIM Pro is a commercial sibling of DWSIM built on top of open-source software. It offers extended features, comes with private support, and is accessible in the...
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    Downloads: 2,968 This Week
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  • 2

    ERmod

    Approximate solvation free energy calculator

    ...The program allows users to calculate the solvation free energy to arbitrary solvents, including inhomogeneous systems, and can run in cooperation with state-of-art molecular simulation software, such as LAMMPS, GROMACS and/or AMBER.
    Downloads: 10 This Week
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  • 3
    CEA Simplified

    CEA Simplified

    tkinter wrapper for NASA CEA focused in rocket chemistry explanations

    CEA Simplified is a GUI for a released version of NASA's CEA program from the 1970s. It is similar to the rocketCEA library for python or the ProPEP GUIs in that it attempts to provide an updated tool for using the same underlying software, but it is more focused on being beginner friendly.
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    Downloads: 10 This Week
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  • 4
    Cantera
    Cantera is a suite of object-oriented software tools for problems involving chemical kinetics, thermodynamics, and/or transport processes. It can be used from MATLAB, Python, C++, or Fortran.
    Downloads: 27 This Week
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  • 5
    APBS

    APBS

    Biomolecular electrostatics software

    This software has moved to http://www.poissonboltzmann.org/.
    15 Reviews
    Downloads: 0 This Week
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  • 6
    LOOS

    LOOS

    Analyze molecular simulation data

    LOOS is a light-weight object oriented software library for creating new tools for analyzing molecular simulation data, written in C++. The main design goal is to allow casual programmers to easily implement new analysis methods. THIS PAGE IS NO LONGER UPDATED. Please see https://github.com/GrossfieldLab/loos for all recent developments
    Downloads: 0 This Week
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  • 7
    WavePacket

    WavePacket

    Dynamics of quantum systems, controlled by external fields

    WavePacket is a toolkit for numerical simulation of distinguishable particles. It can solve single or coupled time-independent or time-dependent (linear) Schrödinger and Liouville-von Neumann-equations, as well as classical or quantum-classical Liouville equations. External electric fields can be added within the semiclassical dipole approximation, thus WavePacket can be used to simulate modern experiments involving ultrashort light pulses in photo-induced physics or chemistry, including quantum optimal control. ...
    Downloads: 0 This Week
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  • 8
    pychemqt

    pychemqt

    Chemical Engineering process simulations program

    pychemqt is a software for simulate units operations in Chemical Engineering
    Downloads: 1 This Week
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  • 9
    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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  • 10
    Software package for stochastic and hybrid simulation of microtubule dynamics and the effects of anti-mitotic drugs and microtubule regulatory proteins.
    1 Review
    Downloads: 0 This Week
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