The cellulose/lignin assembly assessed by molecular modeling. Part 1: adsorption of a threo guaiacyl β-O-4 dimer onto a Iβ cellulose whisker

<scp>CHARMM</scp>: A program for macromolecular energy, minimization, and dynamics calculations

Bernard R. Brooks, Robert E. Bruccoleri, Barry D. Olafson et al. · Journal of Computational Chemistry · 1983 · 14.9K citations

Natural Sciences, Chemistry, Biomolecular Modeling +13

Crystal Structure and Hydrogen-Bonding System in Cellulose Iβ from Synchrotron X-ray and Neutron Fiber Diffraction

Yoshiharu Nishiyama, Paul Langan, Henri Chanzy · Journal of the American Chemical Society · 2002 · 3K citations

Natural Sciences, Chemistry, Materials Science +17

Native Cellulose: A Composite of Two Distinct Crystalline Forms

Rajai H. Atalla, David L. VanderHart · Science · 1984 · 1.2K citations · Full text

Pharmacy, Biochemistry, Botany +15

Electron diffraction study on the two crystalline phases occurring in native cellulose from an algal cell wall

Junji Sugiyama, R. Vuong, Henri Chanzy · Macromolecules · 1991 · 778 citations

Natural Sciences, Biochemistry, Chemistry +17

Studies of microstructure in native celluloses using solid-state carbon-13 NMR

David L. VanderHart, R.H. Atalla · Macromolecules · 1984 · 604 citations

Natural Sciences, Biochemistry, Chemistry +15