Showing 84 open source projects for "file::rsyncp"

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  • 1

    fluids-sh

    acquire fluid properties from the NIST Chemistry WebBook

    fluid.sh is a shell script which utilized wget to acquire fluid properties from the NIST Chemistry WebBook in a format suitable for further processing with shell scripts or e.g. xmgrace. It supports the full functionality provided by the website! The script takes the same input as command line arguments you need to enter on the web forms. It produces a ASCII text file containing the respective data points in columns headed by a well readable description. The advantage is that you do not need...
    Downloads: 0 This Week
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  • 2
    mobcalPARSER

    mobcalPARSER

    A cross-platform interface for the *.mfj file format.

    mobcalPARSER is a command line based PERL frontend/interface for MOBCAL with limited wrapper functionality. "MOBCAL - A Program to Calculate Mobilities" is available from Professor Martin F. Jarrold's webpage http://www.indiana.edu/~nano/software.html.
    Downloads: 0 This Week
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  • 3
    Starch CLD fit

    Starch CLD fit

    Least-squares fit of amylopectin chain-length distribution

    ... .zip file contain the main code readily usable after compiling. An instruction manual is also provided. This is an open source program.
    Downloads: 1 This Week
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  • 4
    pyisocalc

    pyisocalc

    Isotopic pattern calculator in python 2.x

    This is an isotopic pattern calculator written in python. It depends on re, sys, numpy, operator, itertools, and matplotlib.
    Downloads: 0 This Week
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  • 5

    MionChrom

    Signal processing for chromatography

    MionChrom interprets ASCII data from GC-C-IRMS systems, plots it, identifies peaks and autointegrates the results. The user can manually integrate peaks with different tools. The results is reported in *.XLS, *.TXT and *.PNG. ------------------------------------------------------ MionChrom is soon to be replaced by MionMass which isn't a open sourced project.
    Downloads: 0 This Week
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  • 6

    STT simulador para trocadores tubulares

    STT - Simulador para trocadores tubulares utilizando o método Kern

    STT - Simulador para Trocadores Tubulares Simulador para trocadores de calor dos tipos: bitubular e casco e tubos. O software utiliza o método Kern para cálculo de trocadores de calor, possui base de dados atualizável para as propriedades dos fluidos e dimensões dos tubos, facilitando o uso e minimizando a entrada de dados. O STT trabalha no sistema de unidades internacional e no sistema inglês e possui interface para sistema operacional Windows (XP, 7, Vista)
    Downloads: 4 This Week
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  • 7
    ProcessTiming

    ProcessTiming

    Timer to ease your film development processes

    A Mac OS X App to time your film development processes, f.ex. rotary process phases (like E6, C41). New processes can be added simply by adding a CSV file.
    Downloads: 2 This Week
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  • 8
    Chemitorium
    Free Organic Chemistry Analysis and Visualisation Tool; Chemical formula editor, calculation of threedimensional molecular structures, high-quality realtime rendering, ...
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    Downloads: 1 This Week
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  • 9
    Ion Chromatography Data Analyzer for analyzing wasted oil. Can parse data file from HW2000 workstation.
    Downloads: 0 This Week
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  • 10
    MIPGen

    MIPGen

    Simple Molecular Interaction Potential Generator in Python

    Molecular Interaction Potential Generator MIPGEN is a python program that will calculate Molecular Interaction Potential grids over a given molecule, that could be either a protein or a small organic compound (drug). The output will be a series of grids with DX format (*.dx) that the user will be able to visualize using any Molecular visualization program like VMD, PyMol, Chimera... For more information on dependencies and usage, please read the Documentation. Users are welcome...
    Downloads: 0 This Week
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  • 11
    Adjusting PKL-Files derived from MS-experiments. The development of the project has been MOVED TO https://github.com/binfalse/adjustpkl
    Downloads: 1 This Week
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  • 12
    A framework to support scientific experiments: acquiring, visualizing, analyzing, and managing experimental data. Initially developed to support the experimental process on two beamlines at the Canadian Light Source synchrotron (lightsource.ca).
    Downloads: 0 This Week
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  • 13
    ChemLearing is a lightweight, easy to use e-learning platform - for both the student as well as the teacher.
    Downloads: 0 This Week
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  • 14
    Metmask has moved to github http://github.com/hredestig/metmask Metmask is a tool written in python for managing chemical identifiers for metabolomics experiments. It can incorporate identifiers from local textfiles, several online databases, query PubChem and record all found associations in a local sqlite database.
    Downloads: 0 This Week
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  • 15
    OpenThermo

    OpenThermo

    Statistical thermodynamics package

    OpenThermo is a program package for statistical thermodynamics computations beyond rigid rotor - harmonic oscillator approximation
    Downloads: 0 This Week
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  • 16
    bni-tools
    --UPDATE-- New Version is now integrated in the official PyMOL plugin repository! --UPDATE-- The BNI (Beyond Normal Interaction)- Tools is a plug in for the PyMOL molecular visualization system which adds additional functionalities and presets to the PyMOL GUI and also adds useful extended commands.
    Downloads: 0 This Week
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  • 17
    An editor for small organic molecules, written in C using gtk+. It can read and write SMILES and cml and can save to dia's file format. It is suitable for creating chemical molecule diagrams for lower level chemistry/ochem lab reports.
    Downloads: 3 This Week
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  • 18
    Java Data Processing Project aims to manipulate text file containing scientific data such as time/intensity scan or spectrum. Jdpp provide large flexibility to read all possible time duration and date format. It is originally design to treat MS data.
    Downloads: 1 This Week
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  • 19
    LabDiary
    LabDiary is a program for managing laboratory experiments in a sophisticated way. It is very easy to use - you can link experiments logically with each other, associate files to an experiment and structure all your data.
    Downloads: 0 This Week
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  • 20
    The Chemical Structures Project is a set of 3D structures of molecules in CML format. Each file contains also some physical properties, which can be access using a web browser or a CML file reader.
    Downloads: 0 This Week
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  • 21
    sdf file viewer
    Downloads: 0 This Week
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  • 22
    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.
    Downloads: 6 This Week
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  • 23
    User friendly PDB (Protein Data Bank) file editor with graphic user interface for protein crystallographers to expedite selective parallel edit / data extraction / analysis of their PDB files
    Downloads: 7 This Week
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  • 24
    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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  • 25
    Collection of scripts converting structure data files into different formats (e.g. CTRL to POSCAR).
    Downloads: 0 This Week
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