Journal of Organic and Biomolecular Simulations is an international peer-reviewed journal providing the latest research that enables researchers to evaluate current research and technologies. Articles emphasize technical and scientific applications such as computer-aided molecular design; rational drug design, de novo ligand design, receptor modeling and docking; cheminformatics, data analysis, visualization and mining; computational medicinal chemistry; homology modeling; simulation of peptides, DNA and other biopolymers; quantitative structure-activity relationships (QSAR) and ADME-modeling; modeling of biological reaction mechanisms; and combined experimental and computational studies in which calculations play a major role.
A QUANTUM MECHANICAL STUDY OF STRUCTURAL AND ELECTRONIC DILUTION EFFECTS IN PARAMAGNETIC CHEMICAL EXCHANGE SATURATION TRANSFER AGENTS
Pages : 1-13
DOI : 10.3844/jobsp.2014.1.13
Published On : December 11, 2013