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Grants 2004 2017

Publications 1995 2018

  • 47 h-Index
  • 195 Article
  • 5 Conference contribution
  • 2 Chapter
1 Citations

Improvements to the APBS biomolecular solvation software suite

Jurrus, E. , Engel, D. , Star, K. , Monson, K. , Brandi, J. , Felberg, L. E. , Brookes, D. H. , Wilson, L. , Chen, J. , Liles, K. , Chun, M. , Li, P. , Gohara, D. W. , Dolinsky, T. , Konecny, R. , Koes, D. R. , Nielsen, J. E. , Head-Gordon, T. , Geng, W. , Krasny, R. & 4 others Wei, G. W., Holst, M. J., McCammon, J. A. & Baker, N. A. Jan 1 2018 In : Protein science : a publication of the Protein Society. 27, 1, p. 112-128 17 p.

Research output: Research - peer-reviewArticle

Solvation
Electrostatics
Static Electricity
Software
Insulator Elements
4 Citations

Accurate, robust, and reliable calculations of Poisson–Boltzmann binding energies

Nguyen, D. D., Wang, B. & Wei, G. W. May 15 2017 In : Journal of Computational Chemistry. 38, 13, p. 941-948 8 p.

Research output: Research - peer-reviewArticle

Binding Energy
Ludwig Boltzmann
Free Energy
Siméon Denis Poisson
Grid
3 Citations

Analysis and prediction of protein folding energy changes upon mutation by element specific persistent homology

Cang, Z. & Wei, G. W. Nov 15 2017 In : Bioinformatics. 33, 22, p. 3549-3557 9 p.

Research output: Research - peer-reviewArticle

Protein Folding
Homology
Mutation
Prediction
Energy

Breaking the polar-nonpolar division in solvation free energy prediction

Wang, B., Wang, C., Wu, K. & Wei, G. W. 2017 (Accepted/In press) In : Journal of Computational Chemistry.

Research output: Research - peer-reviewArticle

Feature Vector
Free Energy
Division
Molecules
Prediction
5 Citations

ESES: Software for Eulerian solvent excluded surface

Liu, B., Wang, B., Zhao, R., Tong, Y. & Wei, G. W. 2017 (Accepted/In press) In : Journal of Computational Chemistry.

Research output: Research - peer-reviewArticle

Software
Surface area
Cavity
Cartesian Grid
Electrostatics