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International Journal of Molecular Sciences|April 15, 2016
SAAMBE: Webserver to Predict the Charge of Binding Free Energy Caused by Amino Acids MutationsMarharyta Petukh, Luogeng Dai, Emil AlexovPlos Computational Biology|July 7, 2015
Predicting Binding Free Energy Change Caused by Point Mutations with Knowledge-Modified MM/PBSA MethodMarharyta Petukh, Minghui Li, Emil AlexovBiophysical Journal|January 9, 2007
Poisson-Boltzmann calculations of nonspecific salt effects on protein-protein binding free energiesClaudia Bertonati, Barry Honig, Emil AlexovThe Journal of Physical Chemistry. B|July 21, 2006
Comparative study of generalized born models: Born radii and peptide foldingJiang Zhu, Emil Alexov, Barry HonigJournal of Computational Chemistry|August 23, 2016
Electrostatic component of binding energy: Interpreting predictions from poisson-boltzmann equation and modeling protocolsArghya Chakavorty, Lin Li, Emil AlexovFrontiers in Molecular Biosciences|May 20, 2015
On the energy components governing molecular recognition in the framework of continuum approachesLin Li, Lin Wang, Emil AlexovMathematical Biosciences and Engineering : MBE|March 24, 2021
On regularization of charge singularities in solving the Poisson-Boltzmann equation with a smooth solute-solvent boundarySiwen Wang, Emil Alexov, Shan ZhaoScientific Reports|March 19, 2016
Multiscale method for modeling binding phenomena involving large objects: application to kinesin motor domains motion along microtubulesLin Li, Joshua Alper, Emil AlexovCurrent Pharmaceutical Design|November 23, 2012
The role of protonation states in ligand-receptor recognition and bindingMarharyta Petukh, Shannon Stefl, Emil AlexovJournal of Theoretical & Computational Chemistry|July 15, 2014
On the Modeling of Polar Component of Solvation Energy using Smooth Gaussian-Based Dielectric FunctionLin Li, Chuan Li, Emil AlexovPageof 138