Spectral Moments of the Edge Adjacency Matrix in Molecular Graphs. 1. Definition and Applications to the Prediction of Physical Properties of Alkanes

A novel graph theoretical invariant based on the spectral moments of the edge adjacency matrix (E) is proposed. Spectral moments of the E matrix are used to describe seven physical properties of alkanes. All the regression models found are very significant from the statistical point of view. The spe... View More