Development of a solvent database for pure and mixed solvents; Modeling of receptors and their ligands, especially the acetylcholine (muscarainic and nicotinic), t he sigma and PCP receptors and the pleasure receptor (cocaine and other abusive drugs); modeling of the interaction between antimalarial agents such as artemisinin (qinghaosu) with hemin; calculation of preferred structures of biologically and theoretically important molecules.
