Scientific Papers

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Revision as of 10:29, 19 September 2012

• [GRENA] J.A.Kereselidze, Z.V.Pachulia, T.Sh.Zarqua
  Quantum-chemical description of prototropic tautomerism of pyrimidine bases
  Chemistry of Heterocyclic Compounds
  DOI: 10.1007/s10593-009-0331-6
• [GRENA] M. Kvaraia, J. Kereselidze, Z. Pachulia and T. Zarqua
  Quantum-Chemical Study of the Solvent Effect on Process of a Proton Transfer in Nucleotide Bases
  Proceed. Georgian NA Sciences
  
• [GRENA] T. Zarqua, J. Kereselidze and Z. Pachulia
  Quantum-chemical description of the influenceof electronic effects of proton transfer in guanine-cytosine base pairs
  Journal of Biological Physics and Chemistry
  ISSN 1512-0856
• [GRENA] J. Kereselidze, Z. Pachulia and M. Kvaraia
  Quantum-chemical modeling of tendency of DNA to denaturetion
  J.Biol. Phys. Chem.
  ISSN: 1512-0856
• [GRNET, IOPC] A. Avramopoulos, J. Li, N. Holzmann, G. Frenking, M. G. Papadopoulos
  On the Stability, Electronic Structure, and Nonlinear Optical Properties of HXeOXeF and FXeOXeF
  The Journal of Physical Chemistry A
  DOI: 10.1021/jp203961k
• [GRNET, IOPC] B. Skwara, R. G. Gora, R. Zalesny, P. Lipkowski, W. Bartkowiak, H. Reis, M. G. Papadopoulos
  Electronic Structure, Bonding, Spectra, and Linear and Nonlinear Electric Properties of Ti@C28
  The Journal of Physical Chemistry A
  DOI: 10.1021/jp206331n
• [GRNET, IOPC] E. Koukaras, A. D. Zdetsis, P. Karamanis, C. Pouchan, A. Avramopoulos, M. G. Papadopoulos
  Structural and static electric response properties of highly symmetric lithiated silicon cages: Theoretical predictions
  Journal of Computational Chemistry
  DOI: 10.1002/jcc.22938
• [GRNET, IOPC] G. Megariotis, A. Avramopoulos, M. G. Papadopoulos, H. Reis
  Computer Simulation of the Nonlinear Optical Properties of Langmuir–Blodgett Films of a Squaraine Derivative
  Journal of Physical Chemistry C
  DOI: 10.1021/jp304246a
• [IIAP_NAS_RA] A. Poghosyan, L. Arsenyan, H. Astsatryan, M. Gyurjyan, H. Keropyan and A. Shahinyan
  NAMD Package Benchmarking on the Base of Armenian Grid Infrastructure
  Journal of Communications and Network,
  DOI: 10.4236/cn.2012.41005
• [IIAP_NAS_RA] A. Shahinyan, P. Hakobyan, L. Arsenyan, A. Poghosyan
  The study of lyotropic liquid crystal structure using the molecular dynamics method
   Journal of Molecular Crystals and Liquid Crystals
  DOI: 10.1080/15421406.2012.687174
• [IICT-BAS] E. Atanassov, D. Dimitrov
  Efficient Implementation of Heston Model Using GPGPU
  Monte Carlo Methods and Applications
  ISSN: 0929-9629
• [IICT-BAS] E. Atanassov, S. Ivanovska
  Sensitivity Study of Heston Stochastic Volatility Model Using GPGPU
  Lecture Notes in Computer Science
  DOI: 10.1007/978-3-642-29843-1_49
• [IICT-BAS] E. Atanassov, T. Gurov, A. Karaivanova
  Capabilities of the HPC Cluster at IICT-BAS
  Automatika i Informatika,
  ISSN 0861 -7562
• [IICT-BAS] S. Ivanovska, A. Karivanova and N. Manev
  Numerical Integration Using Sequences Generating Permutations
  Lecture Notes in Computer Science
  DOI: 10.1007/978-3-642-29843-1_51
• [IM-BAS/IICT-BAS] Kiril S. Shterev, Stefan K. Stefanov and Emanouil I. Atanassov
  A parallel algorithm with improved performance of Finite Volume Method (SIMPLETS)
  Lecture Notes in Computer Science
  DOI: 10.1007/978-3-642-29843-1_40
• [IMBB] Oulas A, Karathanasis N, Louloupi A, Poirazi P.
  Finding Cancer-Associated miRNAs: Methods and Tools
  Molecular Biotechnology
  DOI: 10.1007/s12033-011-9416-4
• [IPB] A. Balaz, O. Prnjat, D. Vudragovic, V. Slavnic, I. Liabotis, E. Atanassov, B. Jakimovski and M. Savic
  Development of Grid E-Infrastructure in South-Eastern Europe
  Journal of Grid Computing
  DOI: 10.1007/s10723-011-9185-0
• [IPB] I. Vidanovic, A. Balaz, H. Al-Jibbouri and A. Pelster
  Nonlinear Bose-Einstein-condensate Dynamics Induced by a Harmonic Modulation of the S-wave Scattering Length
  Physical Review B
  DOI: 10.1103/PhysRevA.84.013618
• [IPB] S. Tomic and N. Vukmirovic
  Symmetry Reduction in Multiband Hamiltonians for Semiconductor Quantum Dots: the Role of Interfaces and Higher Energy Bands
  Journal of Applied Physics
  DOI: 10.1063/1.3631048
• [IPB] A. Balaz and A. I. Nicolin
  Faraday Waves in Binary Nonmiscible Bose-Einstein Condensates
  Physical Review A
  DOI: 10.1103/PhysRevA.85.023613
• [IPB] A. Balaz, I. Vidanovic, A. Bogojevic, A. Belic and A. Pelster
  Fast Converging Path Integrals for Time-Dependent Potentials: I. Recursive Calculation of Short-Time Expansion of the Propagator
  Journal of Statistical Mechanics
  DOI: 10.1088/1742-5468/2011/03/P03004
• [IPB] A. Balaz, I. Vidanovic, A. Bogojevic, A. Belic and A. Pelster
  Fast Converging Path Integrals for Time-Dependent Potentials: II. Generalization to Many-Body Systems and Real-Time Formalism
  Journal of Statistical Mechanics
  DOI: 10.1088/1742-5468/2011/03/P03005
• [IPB] A. Balaz, I. Vidanovic, D. Stojiljkovic, D. Vudragovic, A. Belic and A. Bogojevic
  SPEEDUP Code for Calculation of Transition Amplitudes Via the Effective Action Approach
  Communications in Computational Physics
  DOI: 10.4208/cicp.131210.180411a
• [IPB] B. L. M. Hendriksen, F. Martin, Y. Qi, C. Mauldin, N. Vukmirovic, J. Ren, H. Wormeester, A. J. Katan, V. Altoe, S. Aloni, J. M. J. Frechet, L. W. Wang and M. Salmeron
  Electrical Transport Properties of Oligothiophene Based Molecular Films Studied by Current Sensing Atomic Force Microscopy
  Nano Letters
  DOI: 10.1021/nl202720y
• [IPB] D. Tanaskovic, K. Haule, G. Kotliar and V. Dobrosavljevic
  Phase Diagram, Energy Scales, and Nonlocal Correlations in the Anderson Lattice Model
  Physical Review B
  DOI: 10.1103/PhysRevB.84.115105
• [IPB] D. Vudragovic, I. Vidanovic, A. Balaz, P. Muruganandam and S. Adhikari
  C Programs for Solving the Time-dependent Gross-Pitaevskii Equation in a Fully Anisotropic Trap
  Computer Physics Communications
  DOI: 10.1016/j.cpc.2012.03.022
• [IPB] G. Liu, S. Xun, N. Vukmirovic, X. Song, P. Olaide-Velasco, H. Zheng, V. S. Battaglia, L. W. Wang and W. Yang
  Polymers with Tailored Electronic Structure for High Capacity Lithium Battery Electrodes
  Advanced Materials
  DOI: 10.1002/adma.201102421
• [IPB] H. Terletska, J. Vucicevic, D. Tanaskovic and V. Dobrosavljevic
  Quantum Critical Transport Near the Mott Transition
  Physical Review Letters
  DOI: 10.1103/PhysRevLett.107.026401
• [IPB] I. H. Chu, M. Radulaski, N. Vukmirovic, H. P. Cheng and L. W. Wang
  Charge Transport in a Quantum Dot Supercrystal
  The Journal of Physical Chemistry C
  DOI: 10.1021/jp206526s
• [IPB] J. M. Granadino-Roldan, N. Vukmirovic, M. Fernandez-Gomez and L. W. Wang
  The Role of Disorder on the Electronic Structure of Conjugated Polymers. the Case of Poly-2,5-bis(phenylethynyl)-1,3,4-thiadiazole
  Physical Chemistry Chemical Physics
  DOI: 10.1039/c1cp20329k
• [IPB] Lj. Budinski-Petkovic, I. Loncarevic, Z. M. Jaksic, S. B. Vrhovac and N. M. Svrakic
  Simulation Study of Anisotropic Random Sequential Adsorption of Extended Objects on a Triangular Lattice
  Physical Review E
  DOI: 10.1103/PhysRevE.84.051601
• [IPB] M. D. Petrovic and N. Vukmirovic
  Spin Relaxation in CdTe Quantum Dots with a Single Mn Atom
  Physical Review B
  DOI: 10.1103/PhysRevB.85.195311
• [IPB] M. M. Radonjic, D. Tanaskovic, V. Dobrosavljevic, G. Kotliar and K. Haule
  Wigner-Mott Scaling of Transport Near the Two-dimensional Metal-insulator Transition
  Physical Review B
  DOI: 10.1103/PhysRevB.85.085133
• [IPB] M. Zezelj, I. Stankovic, A. Belic
  Finite-size Scaling in Asymmetric Systems of Percolating Sticks
  Physical Review E
  DOI: 10.1103/PhysRevE.85.021101
• [IPB] M. Zezelj, V. Milanovic, J. Radovanovic and I. E. Stankovic
  Influence of Interface Roughness Scattering on Output Characteristics of GaAs/AlGaAs Quantum Cascade Laser in a Magnetic Field
  Journal of Physics D: Applied Physics
  DOI: 10.1088/0022-3727/44/32/325105
• [IPB] N. Lazarevic, M. M. Radonjic, D. Tanaskovic, R. Hu, C. Petrovic and Z. V. Popovic
  Lattice Dynamics of FeSb2
  Journal of Physics: Condensed Matter
  DOI: 10.1088/0953-8984/24/25/255402
• [IPB] N. Lazarevic, M. M. Radonjic, R. Hu, D. Tanaskovic, C. Petrovic and Z. V. Popovic
  Phonon Properties of CoSb2 Single Crystals
  Journal of Physics: Condensed Matter
  DOI: 10.1088/0953-8984/24/13/135402
• [IPB] N. Prodanovic, N. Vukmirovic, D. Indjin, Z. Ikonic and P. Harrison
  Electronic States and Intraband Terahertz Optical Transitions in InGaAs Quantum Rods
  Journal of Applied Physics
  DOI: 10.1063/1.3692069
• [IPB] N. Vukmirovic and L. W. Wang
  Density of States and Wave Function Localization in Disordered Conjugated Polymers: a Large Scale Computational Study
  The Journal of Physical Chemistry B
  DOI: 10.1021/jp1114527
• [IPB] N. Vukmirovic and L. W. Wang
  Overlapping Fragments Method for Electronic Structure Calculation of Large Systems
  Journal of Chemical Physics
  DOI: 10.1063/1.3560956
• [IPB] O. Prnjat, A. Balaz, D. Vudragovic, I. Liabotis, C. Sener, B. Marovic, M. Kozlovszky and G. Neagu
  SEE-GRID EInfrastructure for Regional EScience
  Book chapter in Data driven e-Science: Use Cases and Successful Applications of Distributed Computing Infrastructure
  DOI: 10.1007/978-1-4419-8014-4_7
• [IPB-FCUB] B. Marjanovic, I. Juranic, G. Ciric-Marjanovic
  Comment on Revised Mechanism of Boyland-Sims Oxidation
  Journal of Physical Chemistry A
  DOI: 10.1021/jp2041845
• [IPB-FCUB] B. Drakulic, A. Marinkovic, I. Juranic
  On the choice of optimal conformation in linear free-energy relationships. Reactivity of 2-[(carboxymethyl)sulfanyl]-4-oxo-4-arylbutanoic acids with diphenyldiazomethane
  Tetrahedron Letters
  DOI: 10.1016/j.tetlet.2011.11.097
• [IPB-FCUB] B. J. Drakulic
  How to produce scientific paper using free-of-charge software
  Hemijski Pregled
  ISSN: 0440-6826
• [IPB-FCUB] B. Marjanovic, I. Juranic, G. Ciric-Marjanovic, I. Pasti, M. Trchova, P. Holler
  Chemical oxidative polymerization of benzocaine
  Reactive and Functional Polymers
  DOI: 10.1016/j.reactfunctpolym.2011.03.013
• [IPB-FCUB] B. Marjanovic, I. Juranic, G. Ciric-Marjanovic, M. Mojovic, I. Pasti, A. Janosevic, M. Trchova, P. Holler, J. Horsky
  Chemical oxidative polymerization of ethacridine
  Reactive and Functional Polymers
  DOI: 10.1016/j.reactfunctpolym.2011.10.002
• [IPB-FCUB] Budimir Marjanovic, Ivan Juranic, and Gordana Ciric-Marjanovic
  Revised Mechanism of Boyland Sims Oxidation
  Journal of Physical Chemistry A
  DOI: 10.1021/jp111129t
• [IPB-FCUB] J. Savic, S. Dilber, B. Markovic, M. Milenkovic, S. Vladimirov, I. Juranic
  Docking Studies and α-Substitution Effects on the Anti-Inflammatory Activity of β-Hydroxy-β-arylpropanoic Acids
  Molecules
  DOI: 10.3390/molecules16086645
• [IPB-FCUB] N. Trisovic, N. Valentic, M. Erovic, T. Djakovic-Sekulic, G. Uscumlic, I. Juranic
  Synthesis, structure, and solvatochromic properties of pharmacologically active 5-substituted 5-phenylhydantoins
  Monatshefte fuer Chemie
  DOI: 10.1007/s00706-011-0639-7
• [RENAM, IMI] A. ANDRIEŞ, I. TIGHINEANU, P. BOGATENCOV, I. COJOCARU, R.CUJBA.
  INIŢIATIVA REGIONALĂ DE DEZVOLTARE A EINFRASTRUCTURII PENTRU CERCETARE ŞI INOVARE – SEERA-EI
  Revista de Ştiinţă, Inovare, Cultură şi Artă “ŞTIINŢĂ ŞI INOVARE”
  ISSN 1857-0461
• [RENAM, IMI] PETRU BOGATENCOV, GRIGORE SECRIERU
  CALCULUL PERFORMANT: OPORTUNITĂŢI ŞI PERSPECTIVE PENTRU CERCETARE
  Revista de Ştiinţă, Inovare, Cultură şi Artă “ŞTIINŢĂ ŞI INOVARE”
  ISSN 1857-0461
• [RENAM] B. Rybakin
  “Parallel programming for graphics accelerators.” Under edition by Academician V.B. Betelin. Moscow, SIISI RAS, 2011, 261 p. (Рыбакин В.П. “Параллельное программирование для графических ускорителей." Под редакцией академика РАН В.Б. Бетелина. Москва, НИИСИ РАН, 2011, 261 стр.)
  monograph
  ISBN 978-5-93838-046-2.
• [RENAM] B.P. RYBAKIN
  Modeling of III-D problems of gas dynamics on multiprocessing computers and GPU
  Computers & Fluids
  DOI: 10.1016/j.compfluid.2012.01.016
• [RENAM] RYBAKIN, B.; SIDER, N.
  Numerical modeling of multidimensional problems of gravitational gas dynamics with high resolution schemes
  Matematica
  ISSN 1024–7696
• [UPT]
  An algorithm for gravity anomaly inversion in HPC
  SCPE: Scalable Computing: Practice and Experience
  ISSN 1895-1767