Computational Chemistry and Molecular Modeling : Principles and Applications - Ramachandran, K. I.; Deepa, Gopakumar; Namboori, Krishnan; SpringerLink (Online service) (Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2008)
Symmetry and Point Groups -- Quantum Mechanics: A Brief Introduction -- Hückel Molecular Orbital Theory -- Hartree-Fock Theory -- Basis Sets -- Semiempirical Methods -- The Ab Initio Method -- Density Functional Theory -- Reduced Density Matrix -- Molecular Mechanics -- The Modeling of Molecules Through Computational Methods -- High Performance Computing -- Research in Computational Chemistry and Molecular Modeling -- Basic Mathematics for Computational Chemistry.
Keywords: Chemistry, Physical and theoretical; Chemoinformatics; Chemometrics; Physical chemistry; Theoretical and Computational Chemistry; Computer Applications in Chemistry; Math. Applications in Chemistry; Physical Chemistry