Molecular simulation of surface reorganization and wetting in crystalline cellulose I and II

Amorphous Characteristics of an Ultrathin Cellulose Film

(2011) Eero Kontturi et al.   BIOMACROMOLECULES

A molecular dynamics study of the thermal response of crystalline cellulose Iβ

(2011) Qiong Zhang et al.   CELLULOSE

Torsional Entropy at the Origin of the Reversible Temperature-Induced Phase Transition of Cellulose

(2011) Pan Chen et al.   MACROMOLECULES

On the external morphology of native cellulose microfibrils

(2010) Karim Mazeau   CARBOHYDRATE POLYMERS

PACKMOL: A package for building initial configurations for molecular dynamics simulations

(2009) L. Martínez et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Review: current international research into cellulose nanofibres and nanocomposites

(2009) S. J. Eichhorn et al.   JOURNAL OF MATERIALS SCIENCE

Nanoscale Cellulose Films with Different Crystallinities and Mesostructures—Their Surface Properties and Interaction with Water

(2009) Christian Aulin et al.   LANGMUIR

Efficient Approach To Design Stable Water-Dispersible Nanoparticles of Hydrophobic Cellulose Esters

(2008) Stephanie Hornig et al.   BIOMACROMOLECULES

Wetting the (110) and (100) Surfaces of Iβ Cellulose Studied by Molecular Dynamics

(2008) Karim Mazeau et al.   BIOMACROMOLECULES

Molecular modeling of interfaces between cellulose crystals and surrounding molecules: Effects of caprolactone surface grafting

(2008) Malin Bergenstråhle et al.   EUROPEAN POLYMER JOURNAL

What ice can teach us about water interactions: a critical comparison of the performance of different water models

(2008) C. Vega et al.   FARADAY DISCUSSIONS

1H and 13C solid-state NMR of Gossypium barbadense (Pima) cotton

(2007) R.E. Taylor et al.   JOURNAL OF MOLECULAR STRUCTURE