The electronic structures of infinite linear polymers

New Developments in Molecular Orbital Theory

1951 • 5,347 citations

Conformation of Polypeptides and Proteins

1968 • 2,929 citations

Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 Systems

1966 • 1,906 citations

Quantentheoretische Beitr�ge zum Benzolproblem

1931 • 1,868 citations

Use of the CNDO Method in Spectroscopy. I. Benzene, Pyridine, and the Diazines

1968 • 1,273 citations

Use of the CNDO Method in Spectroscopy. II. Five-Membered Rings

1968 • 423 citations

Calculations of Conformations of Polypeptides

1968 • 387 citations

Conformational energy estimates for statistically coiling polypeptide chains

1967 • 349 citations

Conformational Analysis of Macromolecules. II. The Rotational Isomeric States of the Normal Hydrocarbons

1966 • 254 citations

A discussion of the possibility of bands of energy levels in proteins electronic interaction in non bonded systems

1949 • 215 citations

Physical Methods for Treating the π-Electron Systems of Biopolymers such as Polypeptides and Polynucleotides in the Hückel Approximation

1964 • 27 citations

On the calculation of molecular conformation in crystalline polymers

1964 • 20 citations

Energy Band Structures in Polypeptides

1968 • 14 citations

Contributions to conformational energy from interactions between nonbonded atoms and groups. Part 3.—Stable conformations of linear polyethylene and polytetrafluoroethylene

1965 • 12 citations