Intra-molecular Electro-potential Circuit & ElectroNegatrode: Hypothesis, Algorithm & Implementation for universal indicative rule towards activity of biomolecules

Abstract

No universal indicative rule has been defined till now for activity & selectivity of biomolecules. This lacks very early perception about any molecule (specifically small molecule) in the biological system, beyond doing any experiment. The present study is all about hypothesizing, algorithm development and implementation of theoretical processing of 3D structure of biomolecules in the search of ground for developing perception about biomolecules individually or in combination of other biomolecules. The developed algorithm has been evaluated with small molecules and was found to be implementable as universal indicative rule towards activity & selectivity of biomolecules.