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Computational Biophysics and Bioinformatics

Professor Emil Alexov Group

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Publication


A. Chakravorty, Z. Jia, L. Li, S. Zhao, and E. Alexov
Reproducing the ensemble average polar solvation energy of a protein from a single structure: gaussian-based smooth dielectric function for macromolecular modeling
Journal of chemical theory and computation, 14(2), 1020-1032, 2018
RIS, BibTex

Reference


@article{chakravorty2018reproducing,
  author = "A. Chakravorty and Z. Jia and L. Li and S. Zhao and E. Alexov",
  title = "Reproducing the ensemble average polar solvation energy of a protein from a single structure: gaussian-based smooth dielectric function for macromolecular modeling",
  year = 2018,
  journal = "Journal of chemical theory and computation",
  publisher = "American Chemical Society",
  volume = 14,
  number = 2,
  pages = "1020-1032"
}
 
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