JBR Journal of Interdisciplinary Medicine and Dental Sciences

Molecular Modeling Importance

  Molecular modeling is the branch of  science which  represents the molecular structures numerically and simulates their behavior with the equations of quantum and classical physics. victimisation pc programs, compound scientists might directly generate and acquire molecular knowledge together with geometries, energies, electronic properties, spectroscopic properties, and bulk properties.Molecular modelling encompasses all strategies, theoretical and process, accustomed model or mimic the behaviour of molecules.The strategies area unit utilized in the fields of process chemistry, drug style, process biology and materials science to review molecular systems starting from tiny chemical systems to giant biological molecules and material assemblies. The only calculations are performed by hand, however inevitably computers are a unit needed to perform molecular modelling of any fairly sized system. The common feature of molecular modelling strategies is that the atomistic level description of the molecular systems. this could embody treating atoms because the smallest individual unit (a molecular mechanics approach), or expressly modelling protons and neutrons with its quarks, anti-quarks and gluons and electrons with its photons (a quantum chemistry approach).Using molecular modeling scientists are higher able to style new and tougher medicine against diseases like Cancer, AIDS, and inflammatory disease.Molecular modeling not solely has the potential to bring new medicine to the market, however a massive array of latest materials. the invention of fullerenes, nanotubes and superconducting cuprates (as well as different complicated inorganic compounds), an area unit expected to supply new materials within the optics, ceramic, semiconductor and biomaterials markets.    

High Impact List of Articles

Relevant Topics in General Science