Improvements to the <scp>APBS</scp> biomolecular solvation software suite

Jurrus, Elizabeth; Engel, Dave; T. Star, Keith; Monson, Kyle; Brandi, Juan; E. Felberg, Lisa; H. Brookes, David; Wilson, Leighton; Chen, Jiahui; R. Liles, Karina; Chun, Minju; Li, Peter; W. Gohara, David; J. Dolinsky, T.; Konečný, Robert; Ryan Koes, David; Erik Nielsen, Jens; Head‐Gordon, Teresa; Geng, Weihua; Krasny, Robert; Wei, Guo‐Wei; Holst, Michael; Andrew McCammon, J.; Baker, Nathan

doi:10.1002/pro.3280

Public

Improvements to the APBS biomolecular solvation software suite

Published in Protein Science • Aug 24, 2017

Authors:

Elizabeth Jurrus

Dave Engel

Keith T. Star

Abstract

Abstract The Adaptive Poisson–Boltzmann Solver (APBS) software was developed to solve the equations of continuum electrostatics for large biomolecular assemblages that have provided impact in the study of a broad range of chemical, biological, and biomedical applications. APBS addresses the three ke...

Subject

Electrostatics

Solver

Software suite

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