This is a new project of CCMSI group. We will try to show you our last achievements and results. Here we also giving you some basic information about QSPR/QSAR theory, some new databases concerning nanomaterials and other recently investigated compounds. And finally, we offering you new software developed for QSPR/QSAR analysis of different compounds using SMILES based information and optimal descriptor approach.
Computational Center for Molecular Structure and Interactions
Group
Everything should be made as simple as possible, but not one bit simpler.
Albert
Einstein (1879-1955)
Nanomaterials: whether the QSPR/QSAR analyses are possible?