Theoretical studies of enzymic reactions: Dielectric, electrostatic and steric stabilization of the carbonium ion in the reaction of lysozyme

Electric Moments of Molecules in Liquids

1936 • 5,172 citations

Volumen und Hydratationswärme der Ionen

1920 • 2,234 citations

The Dielectric Polarization of Polar Liquids

1939 • 1,812 citations

Role of a Buried Acid Group in the Mechanism of Action of Chymotrypsin

1969 • 1,060 citations

Calculation of ground and excited state potential surfaces of conjugated molecules. I. Formulation and parametrization

1972 • 736 citations

Consistent Force Field for Calculations of Conformations, Vibrational Spectra, and Enthalpies of Cycloalkane and n-Alkane Molecules

1968 • 638 citations

The Three-Dimensional Structure of an Enzyme Molecule

1966 • 622 citations

Mechanism of Lysozyme Action

1969 • 614 citations

Peptides, polypeptides and proteins

1976 • 530 citations

Real-space refinement of the structure of hen egg-white lysozyme

1974 • 516 citations

The Electrostatic Influence of Substituents on the Dissociation Constants of Organic Acids. I

1938 • 417 citations

Consistent Force Field Calculations. II. Crystal Structures, Sublimation Energies, Molecular and Lattice Vibrations, Molecular Conformations, and Enthalpies of Alkanes

1970 • 376 citations

Ground states of .sigma.-bonded molecules. IX. MINDO [modified intermediate neglect of differential overlap]/2 method

1970 • 360 citations

Rapid geometry optimization for semi-empirical molecular orbital methods

1971 • 342 citations

Energy refinement of hen egg-white lysozyme

1974 • 233 citations

Calculation of .pi..pi.* excited state conformations and vibronic structure of retinal and related molecules

1974 • 206 citations

Crystal structure of a lysozyme-tetrasaccharide lactone complex

1974 • 155 citations

Application of secondary .alpha.-deuterium kinetic isotope effects to studies of enzyme catalysis. Glycoside hydrolysis by lysozyme and .beta.-glucosidase

1969 • 97 citations

A molecular orbital study on the enzymic reaction mechanism of α-chymotrypsm

1973 • 54 citations

Tandem-Mass-Spectrometer Study of Solvated Derivatives of OD−. Total Hydration Energy of the Proton

1970 • 49 citations

Quantum Mechanical Consistent Force Field (QCFF/PI) Method: Calculations of Energies, Conformations and Vibronic Interactions of Ground and Excited States of Conjugated Molecules

1973 • 32 citations

Mechanisms of enzyme action

1970 • 32 citations

CONFORMATIONAL ENERGY CALCULATIONS OF ENZYME‐SUBSTRATE INTERACTIONS. I. Computation of Preferred Conformations of Some Substrates of α‐Chymotrypsin

1972 • 23 citations

Molecular orbital calculations of the catalytic effect of lysozyme

1972 • 13 citations