A biomolecular electrostatics solver using python, GPUs and boundary elements that can handle solvent-filled cavities and stern layers (Q525761): Difference between revisions
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Property / cites work: An Efficient Higher-Order Fast Multipole Boundary Element Solution for Poisson–Boltzmann-Based Molecular Electrostatics / rank | |||
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Revision as of 19:15, 13 July 2024
scientific article
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English | A biomolecular electrostatics solver using python, GPUs and boundary elements that can handle solvent-filled cavities and stern layers |
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A biomolecular electrostatics solver using python, GPUs and boundary elements that can handle solvent-filled cavities and stern layers (English)
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5 May 2017
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biomolecular electrostatics
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implicit solvent
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Poisson-Boltzmann
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boundary element method
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treecode
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Python
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CUDA
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