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Showing 1 - 4 results of 4 for search '(( algorithm allows functional ) OR ( ((algorithm python) OR (algorithm b)) function ))~', query time: 0.27s Refine Results
  1. 1
    Schematics for gmxapi operations.

    Schematics for gmxapi operations. by M. Eric Irrgang (4487278)

    Published 2022
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  2. 2
    Landscape17

    Landscape17 by Vlad Carare (22092515)

    Published 2025
    “…</p><h3>Density functional theory calculations</h3><p dir="ltr">The reference potential energy landscapes were computed using density functional theory with the ωB97x hybrid-energy exchange correlation functional and a 6-31G(d) basis set within Psi4. …”
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  3. 3
    CSPP instance

    CSPP instance by peixiang wang (19499344)

    Published 2025
    “…</b></p><p dir="ltr">Its primary function is to create structured datasets that simulate container terminal operations, which can then be used for developing, testing, and benchmarking optimization algorithms (e.g., for yard stacking strategies, vessel stowage planning).…”
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  4. 4
    Skeletal_ Muscle_MRI_Registration

    Skeletal_ Muscle_MRI_Registration by Lucia Fontana (9435020)

    Published 2020
    “…<p><b>MSKregPy</b> is a collection of algorithms and GUI for muscolo-skeletal image processing and registration.…”
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