QUANTUM‐MECHANICAL STUDIES OF ENVIRONMENTAL EFFECTS ON BIOMOLECULES I. HYDRATION OF FORMAMIDE

New Developments in Molecular Orbital Theory

1951 • 5,347 citations

Structural chemistry and molecular biology

1968 • 1,698 citations

Theory of the hydrogen bond

1972 • 693 citations

Water Molecule Interactions

1970 • 620 citations

A non-empirical study of the hydrogen bond between peptide units

1970 • 215 citations

Electronic States of the Amide Group

1967 • 196 citations

STUDY OF HYDROGEN BONDS IN AMINO ACIDS AND PEPTIDES*

1971 • 195 citations

Energy parameters in polypeptides. II. Semiempirical molecular orbital calculations for model peptides

1970 • 134 citations

Study of the electronic structure of molecules. X

1969 • 123 citations

Ab initio Calculations on cytosine, thymine and adenine

1969 • 109 citations

Stereochemistry of nucleic acid constituents. III. Crystal and molecular structure of adenosine 3'-phosphate dihydrate (adenylic acidb)

1966 • 109 citations

Theoretical investigations on the solvation process

1971 • 107 citations

N- versus O-proton affinities of the amide group: Ab initio electrostatic molecular potentials

1972 • 100 citations

A non-empirical study of hydrogen bonding in the dimer of formamide

1970 • 93 citations

Results of Ab Initio Calculations on Formamide

1970 • 68 citations

SCF MO LCGO studies on hydrogen bondng. The water dimer

1969 • 63 citations

Theoretical investigations on the solvation process

1973 • 46 citations

On the electronic structure of the hydrogen-bond: Formamide and its dimers

1968 • 44 citations

Theoretical investigations on the solvation process

1972 • 44 citations

Non-empirical LCAO-MO-SCF-CI calculations on organic molecules with Gaussian type functions

1968 • 40 citations

Molecular orbital study of the configuration protonation, and hydrogen bonding of secondary amides

1970 • 37 citations

Non-empirical LCAO-MO-SCF-CI calculations on organic molecules with Graussian type functions

1967 • 19 citations

Ab initio studies of hydrogen bonding between peptide units. IV. The mutual orientations of the peptide planes

1972 • 16 citations

A semi-empirical SCF LCAO MO study of the hindered internal rotation in formamide

1971 • 13 citations

An i.r.-spectroscopic study of a postulated C–H ⋯ N hydrogen bond suggested by the X-ray structure of a novel heterocycle

1972 • 6 citations