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Title: A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson–Boltzmann electrostatics

Authors:
 [1] ;  [1] ;  [2] ;  [3] ;  [4]
  1. Department of Mathematics, University of California, San Diego, 9500 Gilman Drive, Mail Code 0112. La Jolla, California 92093-0112, USA
  2. Department of Mathematics, the George Washington University, Monroe Hall, 2115 G St. NW, Washington, DC 20052, USA
  3. Department of Mathematics and Quantitative Biology Graduate Program, University of California, San Diego, 9500 Gilman Drive, Mail Code 0112. La Jolla, California 92093-0112, USA
  4. Department of Chemistry and Biochemistry, Department of Pharmacology, and Howard Hughes Medical Institute, University of California, San Diego, La Jolla, California 92093-0365, USA
Publication Date:
Grant/Contract Number:
AC02-06CH11357
Type:
Publisher's Accepted Manuscript
Journal Name:
The Journal of Chemical Physics
Additional Journal Information:
Journal Name: The Journal of Chemical Physics Journal Volume: 143 Journal Issue: 24; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1223157

Sun, Hui, Wen, Jiayi, Zhao, Yanxiang, Li, Bo, and McCammon, J. Andrew. A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson–Boltzmann electrostatics. United States: N. p., Web. doi:10.1063/1.4932336.
Sun, Hui, Wen, Jiayi, Zhao, Yanxiang, Li, Bo, & McCammon, J. Andrew. A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson–Boltzmann electrostatics. United States. doi:10.1063/1.4932336.
Sun, Hui, Wen, Jiayi, Zhao, Yanxiang, Li, Bo, and McCammon, J. Andrew. 2015. "A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson–Boltzmann electrostatics". United States. doi:10.1063/1.4932336.
@article{osti_1223157,
title = {A self-consistent phase-field approach to implicit solvation of charged molecules with Poisson–Boltzmann electrostatics},
author = {Sun, Hui and Wen, Jiayi and Zhao, Yanxiang and Li, Bo and McCammon, J. Andrew},
abstractNote = {},
doi = {10.1063/1.4932336},
journal = {The Journal of Chemical Physics},
number = 24,
volume = 143,
place = {United States},
year = {2015},
month = {10}
}

Works referenced in this record:

Electrostatics of nanosystems: Application to microtubules and the ribosome
journal, August 2001
  • Baker, N. A.; Sept, D.; Joseph, S.
  • Proceedings of the National Academy of Sciences, Vol. 98, Issue 18, p. 10037-10041
  • DOI: 10.1073/pnas.181342398