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Information × Registration Number 0217U002263, 0116U005096 , R & D reports Title Scientific and technical developments of ILTPE grid infrastructure among the participants of the Europian Grid Infrastructure (EGI) - 2016 popup.stage_title Head Belous Leonid, Registration Date 31-01-2017 Organization B.Verkin Institute for Low Temperature Physics and Engineering NAS of Ukraine popup.description2 An agreement OLA has been peformed on the continuous (7/24) provision of resources of the main cluster of the Institute (site UA_ILTPE_ARC) to service virtual organizations of the Ukrainian grid segment (UNG_UA). The package for quantum mechanical calculations NWCHEM has been optimized In real applications for members of Ukrainian segment of the grid in the US grid infrastructure environment OSG HTCondor. Quantum-mechanical calculations of the physical properties of nanoparticles - the potential transport forms of anticancer drugs has been accomplished using the resources of the Polish grid (VO Gaussian, qcg-icon interface) and the American Grid (OSG, HTCondor interface, NWCHEM package). Product Description popup.authors Білоус Леонід Федорович Приколотін Анатолій Вікторович Рубін Юрій Вадимович popup.nrat_date 2020-04-02 Close