Emil Alexov

Extending the Applicability of the Nonlinear Poisson−Boltzmann Equation:  Multiple Dielectric Constants and Multivalent Ions

Walter Rocchia, Emil Alexov, Barry Honig · The Journal of Physical Chemistry B · 2001 · 829 citations

Natural Sciences, Chemistry, Physics +10

Rapid grid‐based construction of the molecular surface and the use of induced surface charge to calculate reaction field energies: Applications to the molecular systems and geometric objects

Walter Rocchia, S. Sridharan, Anthony Nicholls et al. · Journal of Computational Chemistry · 2001 · 689 citations

Natural Sciences, Chemistry, Physics +17

On the Dielectric “Constant” of Proteins: Smooth Dielectric Function for Macromolecular Modeling and Its Implementation in DelPhi

Lin Li, Chuan Li, Zhe Zhang et al. · Journal of Chemical Theory and Computation · 2013 · 560 citations · Full text

Natural Sciences, Biochemistry, Biophysics +17

Combining Conformational Flexibility and Continuum Electrostatics for Calculating pKas in Proteins

Roxana E. Georgescu, Emil Alexov, M. R. Gunner · Biophysical Journal · 2002 · 470 citations · Full text

Natural Sciences, Biochemistry, Biophysics +14

Incorporating protein conformational flexibility into the calculation of pH-dependent protein properties

Emil Alexov, M. R. Gunner · Biophysical Journal · 1997 · 376 citations · Full text

Life Sciences, Biochemistry, Biophysics +14