Showing 3 open source projects for "development"

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    ParamIT

    a Toolset for Molecular Mechanical Force Field Parameterization

    ParamIT is a toolkit aiding the development of molecular mechanical force field parameterization of small, drag like, molecules within CHARMM general force field (CGenFF) protocol. The developed toolkit helps the researchers in following ways: 1) automating the creation of multiple input files for quantum and molecular mechanics programs, 2) automating the output analysis and 3) substitute the use of full MM programs with a faster specialized one.
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  • 2

    Primes

    Calculate primes by using extremely fast sorting

    This project considers the problem of calculating primes as a sorting problem. It includes the most efficient tree-based sorting algorithm that is possible and shows that finding a new prime can be done by sorting the differences between the previous primes in the right way. Unfortunately it has turned out that going this way is even more slowly than trying to find primes by brute force. So it can only be used as a test with heavy load for the sorting algorithm, which can be used for...
    Downloads: 0 This Week
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  • 3
    Strength in numbers. Existing products we're involved in include port to Linux of Tony Forbes' MFAC for brute-force factorization of MM61 for relatively small factors, and further development and improvement of Tim Charron's ECMnet distributed computing f
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