3 search results - page 1 / 1 » Multipole electrostatics in hydration free energy calculatio... |
JCC
2011
13 years 5 days ago
2011
NAR
2006
13 years 5 months ago
2006
PHEPS (pH-dependent Protein Electrostatics Server) is a web service for fast prediction and experiment planning support, as well as for correlation and analysis of experimentally ...
JCC
2008
13 years 5 months ago
2008
: An efficient method for calculating the free energy of solvation of a (macro)molecule embedded in a continuum solvent is presented. It is based on the fully analytical evaluation...