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Upcoming Events

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Virtual Research Communities

Computational Chemistry VRC

Computational Chemistry Applications

Acronym Application Name Main developer Stage
CFDOF CFD Analysis of Combustion Faculty of Mech. Engineering, University of Banja Luka (UoBL), Bosnia - Herzegovina testing 09.2011
CompChem Quantum Mechanical, Molecular Mechanics, and Molecular Dynamics computation in chemistry Univeristy of Belgrade, Faculty of Chemistry, Republic of Serbia production 09.2011
FMD-PA Design of fullerene and metal-diothiolene-based materials for photonic applications Computational Chemistry Group of NHRF, Greece production 08.2011
HC-MD-QM-CS Hybrid Classical/Quantum Molecular Dynamics – Quantum Mechanical Computer Simulation of Condensed Phases UKIM, Institute of Chemistry, Faculty of Natural Science and Mathematics, FYROM production 08.2011
ISyMAB Integrated System for Modeling and data Analysis of complex Biomolecules IFIN-HH/DPETI, Romania beta 09.2011
MDCisplatin Molecular Design of Platinum Group Metal Complexes as Potential Non-classical Cisplatin Analogues Acad. Roumen Tsanev Institute of Molecular Biology-BAS, Bulgaria beta 09.2011
PCACIC Principal component analysis of the conformational interconversions in large-ring cyclodextrins IOCCP-BAS, Bulgaria production 08.2011


Computational Physics VRC

Overview

Computational Physics is nowadays the main beneficiary of the scientific HPC, large-scale numerical computations being necessary whenever the complexity of the physical systems investigated does not allow the derivation of an analytical solution. The main objective of the Computational Physics VRC is to join together the various physics research teams from the SEE area and to provide them access to a powerful HPC infrastructure and tools which will make possible their participation in multidisciplinary and international collaborations. For this purpose, software developers from 6 countries contributed with 12 applications in the fields of High Energy and Particle Physics, Plasma Physics, Physics of Condensed Matter, Atomic Physics, and Computational Fluid Dynamics. The application range extends from nanoelectronics, micro-devices optimization and the modeling of robotic devices for biomedicine, to improved means for feature detection in satellite images, which leads to better mapping, localization and search services.

Computational Physics Applications

Acronym Application Name Main developer Stage
AMR_PAR Parallel algorithm and program for the solving of continuum mechanics equations using Adaptive Mesh Refinement Institute of Mathematics and Computer Science, Laboratory of Mathematical Modelling, Republic of Moldova production 09.2011
EagleEye Feature Extraction from Satellite Images Using a Hybrid Computing Architecture University Politehnica of Bucharest / Computer Science and Engineering, Romania production 08.2011
FAMAD Fractal Algorithms for MAss Distribution Institute for Space Sciences, Romania testing 07.2011
FuzzyCmeans Parallel Fuzzy C Means for classification/Feature detection category West University of Timisoara/Computer Science Department, Romania production 08.2011
GENETATOMICS Genetic algorithms in atomic collisions Institute of Physics, Faculty of Natural Science and Mathematics, UKIM, FYROM production 09.2011
GIM Geophysical Inversion Modeling Polytechnic University of Tirana, Albania testing 05.2011
HAG High energy physics Algorithms on GPU Institute for Space Sciences, Romania testing 09.2011
HMLQCD Hadron Masses from Lattice QCD University of Tirana, Albania production 07.2011
NUQG Numerical study of ultra-cold quantum gases Scientific Computing Laboratory, Institute of Physics Belgrade, Serbia production 08.2011
SET Simulation of electron transport Institute of Information and Communication Technologies, Bulgarian Academy of Sciences, Bulgaria production 08.2011
SFHG Self Avoiding Hamiltonian Walk on Gaskets Faculty of Mechanical Engineering, Dept. of Thermomechanics, University of Banja Luka, Bosnia and Herzegovina NA
SIMPLE-TS_2D Finite Volume Method for calculation of 2D gas-microflows using standard MPI Kiril Stoyanov Shterev and Stefan Kanchev Stefanov, Institute of Mechanics – BAS / Department of “Complex and multiphase Flows”, Bulgaria production 08.2011

Life Sciences VRC

Life Sciences Applications

Acronym Application Name Main developer Stage
CMSLTM Computational Models of Short and Long Term Memory George Kastellakis, IMBB-FORTH, Greece production 09.2011
DeepAligner Deep sequencing for short fragment alignment Windisch Gergely, Márton Judit, Keményfi Timea, Obuda University (OU), John von Neumann Faculty of Informatics, Biotech Group, Hungary testing 09.2011
DiseaseGene In-silico Disease Gene Mapper Windisch Gergely, MártonJudit, Keményfi Timea, Obuda University (OU), John von Neumann Faculty of Informatics, Biotech Group, Hungary testing 09.2011
DNAMA DNA Multicore Analysis School of Computer & Communication Sciences, Laboratory for Computational Biology and Bioinformatics, RAxML software, Montenegro testing 09.2011
MDSCS Molecular Dynamics Study of Complex systems Dr. Armen Poghosyan, Dr. Hrachya Astsatryan, National Academy of Sciences of the Republic of Armenia production 07.2011
miRs Searching for novel miRNA genes and their targets Anastasis Oulas, IMBB/FORTH, Greece production 05.2011
MSBP Modeling of some biochemical processes with the purpose of realization of their thin and purposeful synthesis Jumber Kereselidze, Tbilisi State University Department of Natural Science, Georgia testing 08.2011

User Guidelines

Getting Access to HP-SEE Infrastructure

Porting Support

Supporting Tools

HPC Infrastructure Operations

HPC Centers

Core Services

Core Applications

Monitoring Tools

Network Operations

Software Stack and Technology Watch

Dissemination and Training

HPC Initiatives, Procurement and Organization Guidelines

Templates

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