Mariusz Makowski

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Simple analytical functions consisting of electrostatic, polarization, Lennard-Jones or modified Lennard-Jones, and cavity terms are proposed to express the potentials of mean force analytically for(More)
A physics-based model is proposed to derive approximate analytical expressions for the cavity component of the free energy of hydrophobic association of spherical and spheroidal solutes in water. The(More)
The physics-based potentials of side-chain-side-chain interactions corresponding to pairs composed of charged and polar, polar and polar, charged and hydrophobic, and hydrophobic and hydrophobic side(More)