Foreword
SIMBEX: a portal for the a priori simulation of crossed beam experiments
VMSLab-G: a virtual laboratory prototype for molecular science on the Grid
A prototype of distributed molecular visualization on computational grids
Parallelization of a relativistic DFT code
Fullerenes as polyradicals
Effect of size and deformation on polarizabilities of carbon nanotubes from atomic increments
Coherent triplet and singlet states in tubulin dynamics
A theoretical investigation of the Chalk–Harrod and modified Chalk–Harrod mechanisms involved in hybrid integrated circuit building
A theoretical approach to molecular batteries: CC bonds functioning as electron shuttles
Phenylium and naphtylium cations in the interstellar medium: a density functional study on their reactivity towards D2 molecules
Local orbitals for excited states
Parallelization strategies for quantum reactive scattering codes
Continuous interacting ant colony algorithm based on dense heterarchy
Low computational cost integrity for block ciphers
Group-oriented signature scheme with distinguished signing authorities
Towards solution of the set-splitting problem on gel-based DNA computing
A nonrepudiable threshold multi-proxy multi-signature scheme with shared verification
Performance of adaptive space-sharing policies in dedicated heterogeneous cluster systems