PyGBe: Python, GPUs and Boundary elements for biomolecular electrostatics

Jupyter Notebook Python C++ C Submitted 21 July 2016Published 18 August 2016
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Editor: @arfon (all papers)
Reviewers: @kyleniemeyer (all reviews)

Authors

Christopher D. Cooper (0000-0003-0282-8998), Natalia C. Clementi (0000-0002-0575-5520), Gilbert Forsyth (0000-0002-4983-1978), Lorena A. Barba (0000-0001-5812-2711)

Citation

Cooper et al, (2016), PyGBe: Python, GPUs and Boundary elements for biomolecular electrostatics, Journal of Open Source Software, 1(4), 43, doi:10.21105/joss.00043

@article{Cooper2016, doi = {10.21105/joss.00043}, url = {https://doi.org/10.21105/joss.00043}, year = {2016}, publisher = {The Open Journal}, volume = {1}, number = {4}, pages = {43}, author = {Christopher D. Cooper and Natalia C. Clementi and Gilbert Forsyth and Lorena A. Barba}, title = {PyGBe: Python, GPUs and Boundary elements for biomolecular electrostatics}, journal = {Journal of Open Source Software} }
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electrostatics biophysics Poisson-Boltzmann

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