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The Poisson–Boltzmann equation can be applied to biomolecular systems. One example is the binding of electrolytes to biomolecules in a solution. This process is dependent upon the electrostatic field generated by the molecule, the electrostatic potential on the surface of the molecule, as well as the electrostatic free energy. [13]
The Taft equation is a linear free energy relationship (LFER) used in physical organic chemistry in the study of reaction mechanisms and in the development of quantitative structure–activity relationships for organic compounds. It was developed by Robert W. Taft in 1952 [2] [3] [4] as a modification to the Hammett equation. [5]
Siméon Denis Poisson. Poisson's equation is an elliptic partial differential equation of broad utility in theoretical physics.For example, the solution to Poisson's equation is the potential field caused by a given electric charge or mass density distribution; with the potential field known, one can then calculate the corresponding electrostatic or gravitational (force) field.
Thomson's problem is related to the 7th of the eighteen unsolved mathematics problems proposed by the mathematician Steve Smale — "Distribution of points on the 2-sphere". [2] The main difference is that in Smale's problem the function to minimise is not the electrostatic potential 1 r i j {\displaystyle 1 \over r_{ij}} but a logarithmic ...
D&H say that, due to the "mutual electrostatic forces between the ions", it is necessary to modify the Guldberg–Waage equation by replacing with , where is an overall activity coefficient, not a "special" activity coefficient (a separate activity coefficient associated with each species)—which is what is used in modern chemistry as of 2007.
Ewald summation, named after Paul Peter Ewald, is a method for computing long-range interactions (e.g. electrostatic interactions) in periodic systems.It was first developed as the method for calculating the electrostatic energies of ionic crystals, and is now commonly used for calculating long-range interactions in computational chemistry.
Faraday's ice pail experiment is a simple electrostatics experiment performed in 1843 by British scientist Michael Faraday [1] [2] that demonstrates the effect of electrostatic induction on a conducting container. For a container, Faraday used a metal pail made to hold ice, which gave the experiment its name. [3]
Protein folding problem: Is it possible to predict the secondary, tertiary and quaternary structure of a polypeptide sequence based solely on the sequence and environmental information? Inverse protein-folding problem: Is it possible to design a polypeptide sequence which will adopt a given structure under certain environmental conditions?