... Among the methods of theoretical investigation of coordination compounds, molecular mechanics seems to be an optimal choice. However, conventional MM force fields typically do lack metal-related force field parameters. ... Let us calculate (MM) energy gradient for experimental structures using purely organic force field with no metal-dependent terms. ... In other words, thus calculated forces give an "imprint" for the derivation of metal-dependent forces. ...

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... About lab . ... Online Journal "Computer graphics and multimedia" (in russian) . ... Algorithms for calculating parameters of virtual scenes in computer vision tasks . ...

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... Applications of Molecular Mechanics to Metal Complexes" . ... Molecular mechanics study of the mixed-ligand lanthanide complexes using Gillespie-Kepert model . ... Within MM-GK, the same parameters are applicable to complexes of different coordination numbers/polyhedra. ... Gillespie-Kepert model . ... Using derived computational parameters, we calculated the geometry of 39 lanthanide ion nonaaqua complexes, 6 octaaqua complexes and 18 beta- diketonate and aqua-beta-diketonate complexes. ...

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• Molecular Mechanics Calculations of beta-Diketonate, Aqua, And

THE PHOTOMETRIC RESEARCHS OF THE MERCURY'S SURFACE BY MEANS OF DIGITAL MODELS. ... The surface brightness of Mercury was measured Danjon (1933, 1949, 1953) and Harris (1961) in phase angle 3o-123o. The analysis of the various data of the integral photometric gives the results of determination of the main photometric constants for Mercury. ... THE PHOTOMETRIC RESEARCHS OF THE MERCURY'S SURFACE: S.G. Pugacheva The surface brightness of the Mercurian images was established on the geologic map Mercury. ...

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• Svetlana G. Pugacheva

... Online Services | ... Construct your query and output by sequental openings of needed fields. One output field must be selected (not be blank) at least. ... Query parameters: . Select for output . ... Energy (keV) . ... Y D H M S MS US NS PS FS AS EV KEV MEV or Stable . ... Energy of the ?-ray (keV) . ... Energy parameters of nucleus (B , Alpha energy, N, P separation energy) . ... Neutron separation energy (keV) . Proton separation energy (keV) . ... Excited energy(keV) . ...

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• CDFE => Online services => Chart of nucleus shape and size parameters
• CDFE => Online Services => Nucleus Ground State Parameters
• CDFE => Online Services => Calculator and Graph Engine for Atomic Nuclei

... The Influence of Microstructure of Media on Nonlinear Acoustic Parameter of Solutions . ... The acoustic nonlinear parameter B/A is strongly structure sensitive as it was shown in [Lesnyanskii et al. ... The values of parameters (Ye/Yid and derivative Ye with respect to pressure) are calculated from offered method [Balankina E.S. Proceeding of XI Session of the Russian Acoustic Society, Moscow, 2001 (http://www.akin.ru/RAO/sess11)] using volumetric-elastic properties of solutions. ...

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• Abstract (Invited)

The MRS group also presents several sets of proton structure functions. ... They are MRS ( ) and MRS ( ) [ MRS-1995 ]. In the case it is supposed that the sea quark and gluon densities are parameterized at small by the function where is the same for the gluon and for the sea quarks. ... The next-to-leading order evaluation and the factorization scheme are used for evaluation of the dependence of structure function. in the [ ] case, correspondingly. ... See complete explanation in [ MRS-1995 ]. ...

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• Parameter section
• Structure of LanHEP input file
• General structure

Next: Star Formation Rate and Up: No Title Previous: Calculation of Evolutionary Tracks . To start calculations, we choose the distributions of the initial binary parameters: the mass of the primary ZAMS component, , binary mass ratio, , orbital separation a . ... whereas the mass ratio distribution is not. ... The zero assumption often made is that the mass ratio distribution has a flat shape, that is binaries with a high mass ratio occur as frequently as those with equal masses. ...

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• Parameters of binary compact star evolution
• Restrictions on the Scenario Parameters
• Initial binary parameters

... A new method is proposed that makes it possible to determine the parameters of the three-dimensional (3D) multiwell potential of off-center atoms from extended X-ray absorption fine-structure (EXAFS) data. ... The parameters of the multiwell potential for Ge atoms in the Sn 1-x Ge x Te solid solution as functions of temperature and composition (77<T<300 K, x>0.4) were obtained in the classical approximation. ...

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• New methods of measuring photoelectric parameters of silicon
• Local field and optical second harmonics generation in polar Langmuir-Blodgett
• EXAFS studies of semiconductors and ferroelectrics

... Sergey V. Borisov . ... Kaplan A.Ya ., Borisov S.V. , Zheligovsky V.A. Classification of EEG's of adolescents based on spectral and segment parameters for the purposes of schizophrenia diagnostics // Biological Psychiatry, 2005 (ISSN 0006-3223), submitted . Borisov S.V. , Kaplan A.Ya ., Gorbachevskaya N.L., Kozlova I.A. Structural organization of the EEG alpha activity in adolescents with schizophrenic spectrum disorders // Zh . ... Borisov S.V. , Gorbachevskaya N.L., Kaplan A.Ya . ...

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Databases (NSDC) of the Natural Planetary Satellites. ... NSDC: Database of astrometric observations of Natural Planetary Satellites . ... They are thoroughly looking for observations in different sources, creating their owndatabases which are then mostly inaccessible to other researchers. ... In the file "content" with explications, the reference is given to the data source as well as the bibliographic reference. ... Data sources. ... Why a specific bibliographic database for Natural satellites? ...

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• Scientific activity
• IMCCE-SAI: Natural Satellites Data Center (NSDC). Parameters

Выберите категорию обращения: Общие вопросы Отчеты Рейтинги Диссертационные советы Конкурсы Ввод данных Структура организаций Пользователи Проблемы с регистрацией\входом в систему . ... Войти в систему . ... Vishnevskiy Yury V. , Tikhonov Denis . ... Vogt N. , Vishnevskiy Y.V. , Ivanov A.A. , Vogt J., Vilkov L.V. в журнале Russ. ... Dorofeeva O.V. , Vishnevskiy Y.V. , Moiseeva N.F. в журнале Structural Chemistry , издательство Springer-Verlag (Heidelberg, Germany) , том 17, ? ...

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• Proceedings of the Solar Wind 11 Conference - журнал | ИСТИНА -
• Sheftel' E.N. - сотрудник | ИСТИНА - Интеллектуальная Система Тематического
• Journal of Physics: Conference Series - журнал | ИСТИНА - Интеллектуальная

Электронная библиотека . ... Главная Ex Libris Книги Журналы Статьи Серии Каталог Wanted Загрузка ХудЛит Справка Поиск по индексам Поиск . ... Поиск по указателям . Результат поиска . Книга . Страницы для поиска . ... Agrachev A.A., Sachkov Yu.L. - Control theory from the geometric viewpoint . ... Gonzalez-Miranda J.M. - Synchronization and Control of Chaos: An Introduction for Scientists and Engineers . ... Электронная библиотека попечительского совета мехмата МГУ , 2004-2016 . ...

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• Drmac Z. (ed.), Tutek Z. (ed.), Marusic M. (ed.) - Proceedings of the
• Smith R.C., Demetriou M.A. - Research Directions in Distributed Parameter
• Bishwal J.P. - Parameter Estimation in Stochastic Differential Equations ::

... Structure of Data . ... Catalog . ... Catalog: 206 clusters 32 clusters: known before 12 clusters: parameters from BVRI photometry @ SAO 1-m 0 clusters: parameters from UBVRI photometry @ Maidanak 1.5-m 26 clusters: parameters from 2MASS 168 clusters: new (2MASS) 142 clusters: parameters from 2MASS 26 clusters: embedded 0 clusters: parameters from BVRI photometry @ SAO 1-m 3 clusters: parameters from UBVI photometry @ ARIES 1.04-m 0 clusters: parameters from UBVRI photometry @ Maidanak 1.5-m . ...

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• SAI Open Star Clusters (SAI OCL) Catalog
• SAI OCL Catalog Description

... Publications . ... Laboratory of Mathematical Methods of Image Processing . Chair of Mathematical Physics . ... Algorithms for calculating parameters of virtual scenes in computer vision tasks . Publication type . Conference paper . ... 21-th International Conference on Computer Graphics GraphiCon'2011 . ... Title = {Algorithms for calculating parameters of virtual scenes in computer vision tasks}, . ... BookTitle = {21-th International Conference on Computer Graphics GraphiCon'2011}, . ...

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... Proceedings 2009 . Proceedings 2008 . ... Proceedings 2004 . ... Design, construction and operation of the magnetic systems of some electrophysical setups require a preliminary mathematical modeling as well as a constant maintenance of mathematical modeling when debugging and operating the setups. ... This work discusses the results on the numerical modeling of the distributing magnetic field for some modifications of the spectrometric magnet SP-94 used in some experimental setups. ...

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• Heat transfer in non-uniform by structure monodisperse system, containing
• MCE-2016
• Conference publications

... MPI_Cart_map . Maps process to Cartesian topology information #include "mpi.h" int MPI_Cart_map ( comm_old, ndims, dims, periods, newrank ) MPI_Comm comm_old; int ndims; int *dims; int *periods; int *newrank; . ... All MPI routines (except MPI_Wtime and MPI_Wtick ) return an error value; C routines as the value of the function and Fortran routines in the last argument. ... MPI_SUCCESS . ... Some argument is invalid and is not identified by a specific error class (e.g., MPI_ERR_RANK ). ... Центры . ...

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• MPI_Cart_shift | PARALLEL.RU - Информационно-аналитический центр по
• MPI_Cart_rank | PARALLEL.RU - Информационно-аналитический центр по параллельным
• MPI_Cartdim_get | PARALLEL.RU - Информационно-аналитический центр по

Low-frequency approximation and the choice of optimal elastic parameters for two-layer blast protection jackets" . Tikhonravov A.V., Trubetskov M.K., Winfree N.A., Kang J.H. Low-frequency approximation of elastic wave transmittance for two-layer structures is proposed. An accuracy of the approximation in a range up to several kilohertz is studied. Based on this approximation, the problem of the optimal elastic parameter choice for two-layer blast protection jackets is considered. ...

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• "Nonuniqueness of shockwave structures in real gases: the Mach and/or regular
• "On restoration of noisy signals by a regularization method"
• "Signal reconstruction by the method of regularization"

... The RADEN data bank produced at the Department of Chemistry of Moscow State University is designed as well to accumulate published information on radiative parameters of diatomic molecules, as to analyse it and recommend the more reliable values. ... electronic transition moments D ( R ); . ... dipole moments, . ... FACTUAL RECOMMENDED DATABASE contains now the ab initio and experimental electronic transition moments for more than 250 band systems which belong to more than 100 diatomic molecules. ...

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• Liana N. Sviridova:CV

... If there's no significant multiple alignment , including the sequence, that you interest, then the secondary structure is built, using only the energy model (just the potential energy of the system is minimized), but very often such method will give unreliable results. ... It should be mentioned that by default, at alignment case, the RNA secondary structure will be predicted for the first sequence of the alignment. ... It is done through optimizing, not the real, but model energy of the structure. ...

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• IGLA-3D User Guide
• OUTPUT