Computation of the dipole moments of proteins

AREAS, VOLUMES, PACKING, AND PROTEIN STRUCTURE

1977 • 2,631 citations

Calculation of the electric potential in the active site cleft due to α-helix dipoles

1982 • 931 citations

Prediction of Ph-dependent Properties of Proteins

1994 • 811 citations

Focusing of electric fields in the active site of Cu‐Zn superoxide dismutase: Effects of ionic strength and amino‐acid modification

1986 • 759 citations

Hydrodynamic properties of complex, rigid, biological macromolecules: theory and applications

1981 • 614 citations

The role of the α-helix dipole in protein function and structure

1985 • 517 citations

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

1974 • 516 citations

Polar hydrogen positions in proteins: Empirical energy placement and neutron diffraction comparison

1988 • 498 citations

Interpretation of protein titration curves. Application to lysozyme

1972 • 482 citations

Structure of concanavalin A at 2.4-Ang resolution

1972 • 477 citations

Neutron diffraction reveals oxygen–histidine hydrogen bond in oxymyoglobin

1981 • 449 citations

Structure of bovine pancreatic phospholipase A2 at 1.7 Å resolution

1981 • 429 citations

Refined crystal structure of carboxypeptidase a at 1·54 Å resolution

1983 • 391 citations

Multiple‐site titration and molecular modeling: Two rapid methods for computing energies and forces for ionizable groups in proteins

1993 • 293 citations

Structure of α-chymotrypsin refined at 1.68 Å resolution

1985 • 285 citations

The interaction of proteins with hydroxyapatite

1984 • 275 citations

Isoelectric points of proteins: A table

1978 • 262 citations

The Influence of Dipole Moment Fluctuations on the Dielectric Increment of Proteins in Solution

1952 • 226 citations

Bovine chymotrypsinogen A

1985 • 215 citations

Predicting protein diffusion coefficients.

1993 • 182 citations

Coordination complexes and catalytic properties of proteins and related substances. 104. Electrostatic effects in hemoglobin: hydrogen ion equilibriums in human deoxy- and oxyhemoglobin A

1979 • 181 citations

Interdomain motion in liver alcohol dehydrogenase. Structural and energetic analysis of the hinge bending mode.

1986 • 156 citations

The distribution of charged groups in proteins

1986 • 127 citations

Electric properties and structure of DNA restriction fragments from measurements of the electric dichroism

1982 • 95 citations

Segmented anisotropic refinement of bovine ribonuclease A by the application of the rigid-body TLS model

1989 • 91 citations

Matrix‐method calculation of linear and circular dichroism spectra of nucleic acids and polynucleotides

1984 • 72 citations

The nature of protein dipole moments: experimental and calculated permanent dipole of .alpha.-chymotrypsin

1989 • 65 citations

Calculation and measurement of the dipole moment of small proteins: Use of protein data base

1993 • 58 citations

A Comparison of the Three-dimensional Structures of Subtilisin BPN' and Subtilisin Novo

1972 • 57 citations

Dielectric Relaxation of Molecules with Fluctuating Dipole Moment

1965 • 33 citations

Dipole moment and relaxation time of ribonuclease

1974 • 32 citations

Dielectric properties of hemoglobin and myoglobin II. Dipole moment of sperm whale myoglobin

1969 • 32 citations

Electrostatics of hemoglobins from measurements of the electric dichroism and computer simulations

1995 • 31 citations

Use of protein database for the computation of the dipole moments of normal and abnormal hemoglobins

1993 • 21 citations

Electric, optical and hydrodynamic parameters of lac repressor from measurements of the electric dichroism High permanent dipole moment associated with

1987 • 21 citations

Structure of the Tet repressor and Tet repressor-operator complexes in solution from electrooptical measurements and hydrodynamic simulations

1988 • 20 citations

Permanent dipole moment of tRNA's and variation of their structure in solution

1990 • 19 citations

Anisotropy of proton fluctuations and the Kerr effect of protein solutions. Theoretical considerations

1968 • 10 citations

Calculation of the mean-square dipole moment and proton fluctuation anisotropy of hemoglobin at low ionic strength

1969 • 8 citations