Titlebook: High-Performance Computing Infrastructure for South East Europe‘s Research Communities; Results of the HP-SE Mihnea Dulea,Aneta Karaivanova

NAV

Dynamics of Uninhibited and Covalently Inhibited Cysteine Protease on Non-physiological pH,on states of the protein side chains, through the non-bonded interactions that stabilize 3D structures, likely, significantly contribute to difference in stability of uninhibited and covalently inhibited protein on low pH values.

一窝小鸟

遗传学

2196-7326 st-proceedings of HP-SEE User Forum 2012, held in Belgrade, .This book is a collection of carefully reviewed papers presented during the HP-SEE User Forum, the meeting of the High-Performance Computing Infrastructure for South East Europe’s (HP-SEE) Research Communities, held in October 17-19, 2012,

rheumatology

Mechanisms of Polarization,scover the mechanisms and factors, which lead to large NLO properties, which are some of the properties required for materials to be useful in photonic applications. Here we review some of these factors, which lead to interesting or very large NLO properties.

BRUNT

Ventricle

Self-Avoiding Hamiltonian Walks Counting in Parallel Processing Mode,en, with end-points anywhere in the lattice, or with one or both ends fixed at the corner sites. The leading term n is characterized by the value of the connectivity constant 1, which depends on fractal type, but not on the type of HW.

陈旧

Conformational Analysis and HF , Geometry Optimization of Kyotorphine and Its Sulfo-Analogues Norsudipeptides were considered. In all cases, all the lowest-energy conformations adopt a specific .-like conformation with close proximity between the guanidino and phenolic residues. The relative enegies of the different forms, the geometric parameters and the role of the intramolecular hydrogen bonding in stabilizing the structures are discussed.

会议

Number Theory Algorithms on GPU Clusters,s various Number Theory algorithms on GPU clusters and in partial our implementations of integer factorization using NVIDIA CUDA on clusters equipped with NVIDIA GPUs. Also we report results of our experiments regarding the performance of our implementation.

GULLY

Implementation and Benchmarking of New FFT Libraries in Quantum ESPRESSO,mparable with the widely used and vendor-supplied libraries, the same behavior is foreseen in QE. In this paper we present FFTE-enabled and thread-enabled FFTW3 extensions of QE, together with benchmarking and performance results.

Yourself

Book 2014ucture for South East Europe’s (HP-SEE) Research Communities, held in October 17-19, 2012, in Belgrade, Serbia. HP-SEE aims at supporting and integrating regional HPC infrastructures; implementing solutions for HPC in the region; and making HPC resources available to research communities in SEE, reg