Showing 2434 open source projects for "pam-python"

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  • 1

    ERmod

    Approximate solvation free energy calculator

    ERmod (Energy Representation Module) is a program to calculate the solvation free energy based on the energy representation method (J. Chem. Phys. 113, 6070 (2000)). 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: 2 This Week
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  • 2
    BKWSimX

    BKWSimX

    Planung & Simulation kleiner PV-Anlagen

    ...Die Benutzeroberfläche ist intuitiv gestaltet und erlaubt u. a. die Simulation mehrerer PV-Generatoren mit eigener Ausrichtung und Verschattung, den Vergleich unterschiedlicher Speichersysteme sowie die Berücksichtigung aller üblichen Verlustfaktoren. BKWSimX basiert auf Python, nutzt reale Wetterdaten der Europäischen Kommission (PVGIS) und richtet sich an alle, die fundierte Entscheidungen rund um ihre eigene PV-Anlage treffen möchten.
    Downloads: 0 This Week
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  • 3
    GNNPCSAFT

    GNNPCSAFT

    Smart Thermodynamic Modeling with Graph Neural Networks

    The GNNPCSAFT app is an implementation of our project that focuses on using Graph Neural Networks (GNN) to estimate the pure-component parameters of the Equation of State PC-SAFT. We developed this app so the scientific community can access the model's results easily. In this app, the estimated pure-component parameters can be used to calculate thermodynamic properties and compare them with experimental data from the ThermoML Archive. More info on github repository.
    Downloads: 4 This Week
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  • 4

    jif3d

    3D Joint Inversion Framework

    jif3d is a framework for joint inversion of different types of geophysical data in 3D. It currently comprises forward solvers for first arrival traveltimes, scalar and tensor gravity data, magnetics, magnetotellurics, electrical resistivity tomography and surface waves.The framework is flexible in terms of the coupling approach between the different datasets. At the moment cross-gradient coupling, variation of information and deterministic parameter relationships are implemented. Other...
    Downloads: 3 This Week
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    Chemical Trajectory Analyzer

    A software package for processing and analyzing chemical trajectories

    ChemTraYzer creates reaction models from molecular dynamics simulations. It's available as open software (MIT license). Please find a full description @ https://www.ltt.rwth-aachen.de/cms/LTT/Forschung/Forschung-am-LTT/Model-Based-Fuel-Design/Aktuelle-Projekte/~kqbf/ChemTraYzer/lidx/1 M.Döntgen, M.-D.Przybylski-Freund, L.C.Kröger, W.A.Kopp, A.E.Ismail, K.Leonhard, "Automated Discovery of Reaction Pathways, Rate Constants, and Transition States Using Reactive Molecular Dynamics...
    Downloads: 5 This Week
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  • 6
    AStro inFER - a rule miner and executer
    Downloads: 0 This Week
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  • 7
    relax

    relax

    Molecular dynamics by NMR data analysis

    The software package 'relax' is designed for the study of molecular dynamics through the analysis of experimental NMR data. Organic molecules, proteins, RNA, DNA, sugars, and other biomolecules are all supported. It supports exponential curve fitting for the calculation of the R1 and R2 relaxation rates, calculation of the NOE, reduced spectral density mapping, the Lipari and Szabo model-free analysis, study of domain motions via the N-state model and frame order dynamics theories using...
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    Downloads: 6 This Week
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  • 8

    fas4sysmlv2

    The FAS plugin for the upcoming systems modeling standard SysML v2

    The FAS method enables the systematic and partially automated creation of functional architectures from use cases. This platform-independent software for Python supports the needed automation via the SysML v2 REST API. To get started, download the zipped release, unzip it, and follow the instructions provided via FAS4SysMLv2_InstallationAndUse.txt in the extracted folder. It may also be helpful to watch the video you find under "Project Samples", further below on this SourceForge page.
    Downloads: 0 This Week
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  • 9
    Insight Toolkit
    Insight Toolkit (ITK). ITK builds on a proven, spatially-oriented architecture for processing, segmentation, and registration of scientific images in two, three, or more dimensions. New location: https://github.com/InsightSoftwareConsortium/ITK
    Downloads: 0 This Week
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  • 10
    SMILI

    SMILI

    Scientific Visualisation Made Easy

    The Simple Medical Imaging Library Interface (SMILI), pronounced 'smilie', is an open-source, light-weight and easy-to-use medical imaging viewer and library for all major operating systems. The main sMILX application features for viewing n-D images, vector images, DICOMs, anonymizing, shape analysis and models/surfaces with easy drag and drop functions. It also features a number of standard processing algorithms for smoothing, thresholding, masking etc. images and models, both with...
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    Downloads: 4 This Week
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  • 11
    GNNPCSAFT Chat

    GNNPCSAFT Chat

    Chatbot with GNNPCSAFT

    In this app, you can chat with LLM models (Gemini or Ollama) with GNNPCSAFT tools, allowing you to ask questions about the PC-SAFT parameters of various compounds, predict thermodynamic properties, and get insights into the GNNPCSAFT's performance.
    Downloads: 0 This Week
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  • 12
    DAE Tools Project

    DAE Tools Project

    Object-oriented equation-based modelling and optimisation software

    DAE Tools is a cross-platform equation-based object-oriented modelling, simulation and optimisation software. It is not a modelling language nor a collection of numerical libraries but rather a higher level structure – an architectural design of interdependent software components providing an API for: - Model development/specification - Activities on developed models, such as simulation, optimisation, sensitivity analysis and parameter estimation - Processing of the results, such as...
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    Downloads: 12 This Week
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  • 13
    Butiá Robot
    Open, free and extensible plataform for developing robotics projects
    Downloads: 0 This Week
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  • 14
    SIREN

    SIREN

    Renewable Energy Network tool

    SIREN demonstrates how electricity demand may be met by a mix of renewable energy sources. Users explore potential location and scale of renewable energy sources (stations, storage, transmission) to meet electricity demand. SIREN allows you to build scenarios for the energy mix for your area of interest. It is based around the map of your chosen area and allows you to visualise the layout of the existing electricity network plus the additional stations you place on the map to build your...
    Downloads: 3 This Week
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  • 15
    Hyperfit

    Hyperfit

    Software for calibration of hyperelastic constitutive models

    This software allows to fit various hyperelastic constitutive models. Optimal set of parameters of a selected constitutive model can be identified. Many advanced setting, methods and corrections are available to get optimal results according to the user's preference.
    Downloads: 2 This Week
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  • 16
    Computational electromagnetics software. Uses surface Method of Moments, enhanced by using the Multilevel Fast Multipole Method. Code is parallelized and runs on laptops, desktops and clusters. The code precision is adjustable, it is fast and uses little memory. CFIE is used for closed surfaces, and EFIE for open PEC surfaces. Can function on GMSH, GiD and ANSYS meshes.
    Downloads: 1 This Week
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  • 17

    DataPrep

    Python-based data preprocessing tool

    DataPrep v0.2 is a Tkinter-based GUI application/tool designed to assist users in data preprocessing, multicollinearity removal, and feature selection for a wide range of applications in Cheminformatics, Bioinformatics, Data Analysis, Feature Selection, Molecular Modeling, Machine Learning, and Quantitative-structure-property relationship (QSPR) studies. It includes functionality to load, process, and save datasets with support for different preprocessing & multicollinearity removal...
    Downloads: 0 This Week
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  • 18
    TANGO is an object oriented control system for Linux and Windows. It provides a framework in C++, Java and Python for implementing distributed control objects an accessing them via a well-defined API. This sourceforge project a
    Downloads: 0 This Week
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  • 19
    LabRPS

    LabRPS

    Random phenomena generator

    This is an official mirror of LabRPS. Code and release files are primarily hosted on https://github.com/LabRPS/LabRPS and mirrored here LabRPS aims to be a tool for the numerical simulation of random phenomena such as stochastic wind velocity, seismic ground motion, sea surface ... etc. It can be in a wide range of uses around engineering, such as random vibration or vibration fatigue in mechanical engineering, buffeting analysis in bridge engineering.... LabRPS is mainly to assist...
    Downloads: 0 This Week
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  • 20
    STRIKER-GUI

    STRIKER-GUI

    Refine the spectral library to enhance its completeness and coverage.

    STRIKER is a tool for correcting spectra with missing or incorrect adduct annotations. It also enables efficient construction of an HMDB-based spectral library and extraction of sublibraries from large spectral libraries.
    Downloads: 0 This Week
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  • 21
    FractalRenderingApp

    FractalRenderingApp

    Lightweight app for visualization of Mandelbrot and Julia set

    Source code is available on https://github.com/MarkoLeskovar/FractalRenderingApp
    Downloads: 0 This Week
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  • 22
    CSVSplitter
    # CSV Splitter Uma ferramenta para dividir arquivos CSV em múltiplos arquivos com base na quantidade de registros especificada, mantendo a integridade dos dados e permitindo configurações de charset, separador e formatação. Ideal para lidar com grandes arquivos CSV que precisam ser fragmentados para melhor manuseio e processamento. ## Funcionalidades - **Divisão de CSV**: Divide o arquivo original em múltiplos arquivos CSV, com o número de registros por arquivo definido pelo...
    Downloads: 6 This Week
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  • 23

    RSM

    Radiation Spectrum Method : a modal BPM (Beam Propagation Method)

    RSM (Radiation Spectrum Method) is a 2D rigorous tool to solve the Maxwell equations for the propagation of light in integrated optics or photonics devices. It makes use of an eigenmode expansion method to solve the electromagnetic problem. This software running on Windows and MacOS comes with a GUI that permits to define with the aid of files or scripts the arbitrary and complex geometry of the waveguide. Of that way any waveguide geometry can be handled. Several plots are available :...
    Downloads: 4 This Week
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  • 24
    MaxFEM

    MaxFEM

    Software for electromagnetic simulation

    MaxFem is an open software package for electromagnetic simulation by using finite element methods. The package can solve problems in electrostatics, direct current, magnetostatics and eddy-currents. Since version 0.4.0, MaxFEM requires Python 3. We have moved the installers to the MaxFEM website (see below). In order to improve MaxFEM, we will require you to fill out a simple form before downloading them.
    Downloads: 8 This Week
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  • 25
    Conscious Artificial Intelligence

    Conscious Artificial Intelligence

    It's possible for machines to become self-aware.

    ...A number of prototypes will be developed as the project progresses. This project has 2 subprojects: Object Pascal based CAI NEURAL API - https://github.com/joaopauloschuler/neural-api Python based K-CAI NEURAL API - https://github.com/joaopauloschuler/k-neural-api A video from the first prototype has been made: http://www.youtube.com/watch?v=qH-IQgYy9zg Above video shows a popperian agent collecting mining ore from 3 mining sites and bringing to the base. At the time the agent is born, it doesn't know how to walk nor it knows that it feels pleasure by mining. ...
    Downloads: 1 This Week
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