Bokeh based interface for interactive on-the-fly solution to the modified Poisson-Boltzmann equation in one dimension.
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Jun 18, 2021 - Python
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poisson-boltzmann
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A small Python package to set up electrostatic solvation free energy ("Born energy") calculations of an ion in a membrane protein and calculate the electrostatic free energy with APBS .
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Mar 1, 2022 - Python
Substract two electrostatic maps, contained in Gaussian cube files, and generate a new electrostatic map with the difference.
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May 13, 2020 - Julia
Numerical solver for the modified Poisson-Boltzmann equation.
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Jun 18, 2021 - Python
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