QSPR with descriptors based on averages of vertex invariants. An artificial neural network study
Lionello Pogliani, Jesus Vicente de Julián‐Ortiz · RSC Advances · 2014
Mean molecular connectivity indices (MMCI) defined as averages of vertex invariants together with molecular connectivity indices (MCI) and experimental parameters build optimal semiempirical relationships for eight out of eleven properties of organic solvents studied with artificial neural networks.