1H-NMR and molecular modelling techniques for the investigation of the inclusion complex of econazole with α-cyclodextrin in the presence of malic acid

A new force field for molecular mechanical simulation of nucleic acids and proteins

Scott J. Weiner, Peter A. Kollman, David A. Case et al. · Journal of the American Chemical Society · 1984 · 4.6K citations

Engineering, Altmetric Attention Score, Molecular Biology +21

An all atom force field for simulations of proteins and nucleic acids

Scott J. Weiner, Peter A. Kollman, Dzung T. Nguyen et al. · Journal of Computational Chemistry · 1986 · 3.4K citations

Dimethyl Ether, Engineering, Atom Force Field +17

A molecular mechanical force field for the conformational analysis of oligosaccharides: comparison of theoretical and crystal structures of Man.alpha.1-3Man.beta.1-4GlcNAc

Steve W. Homans · Biochemistry · 1990 · 374 citations

Glycobiology, Altmetric Attention Score, Molecular Biology +22

Topography of cyclodextrin inclusion complexes. XII. Hydrogen bonding in the crystal structure of α-cyclodextrin hexahydrate: the use of a multicounter detector in neutron diffraction

B. Klar, Brian E. Hingerty, Wolfram Saenger · Acta Crystallographica Section B · 1980 · 120 citations

X-ray Crystallography, Inorganic Chemistry, Crystal Structure +8

Preparation and evaluation of ketoconazole-β-cyclodextrin multicomponent complexes

M.T. Esclusa-Díaz · International Journal of Pharmaceutics · 1996 · 64 citations

Pharmacology, Cyclodextrin Production, Ketoconazole-β-cyclodextrin Multicomponent Complexes