Molecular modeling of Ca2+-oligo(α-l-guluronate) complexes: toward the understanding of the junction zone structure in calcium alginate gels

Molecular basis of calcium binding by polyguluronate chains. Revising the egg-box model

(2011) Wojciech Plazinski   JOURNAL OF COMPUTATIONAL CHEMISTRY

Research progress on chemical modification of alginate: A review

(2010) Ji-Sheng Yang et al.   CARBOHYDRATE POLYMERS

Interaction of alginate single-chain polyguluronate segments with mono- and divalent metal cations: a comparative molecular dynamics study

(2010) Lovorka Perić-Hassler et al.   MOLECULAR SIMULATION

Novel alginates prepared by independent control of chain stiffness and distribution of G-residues: Structure and gelling properties

(2009) Kåre A. Kristiansen et al.   CARBOHYDRATE POLYMERS

Conformation, dynamics and ion-binding properties of single-chain polyuronates: a molecular dynamics study

(2008) Lovorka Perić et al.   MOLECULAR SIMULATION

P-LINCS:  A Parallel Linear Constraint Solver for Molecular Simulation

(2007) Berk Hess   Journal of Chemical Theory and Computation

Parameterization of Ca+2–protein interactions for molecular dynamics simulations

(2007) Elad Project et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY