... Molecular Mechanics Calculations of beta-Diketonate, Aqua, And Aqua-beta-Diketonate Complexes of Lanthanide Ions Using Gillespie-Kepert Model . ... Abstract - A version of molecular mechanics based on the Gillespie-Kepert model of coordination bonds "repulsion" is applied to lanthanide complexes. ... For the aqua complexes, typical root-mean-square deviation (calculated vs. ...

Åùå â ðàçäåëå: (Ïîêàçàòü âñå ðåçóëüòàòû (>24) - analyt.chem.msu.ru/ )

Unitherm for Windows (version 4.5) Contents Unitherm for Windows compared to Unitherm for DOS 2 General comments 2 Limitations of Unitherm for Windows compared to Unitherm for DOS 2 Changes in Unitherm interface 2 New functionality of Unitherm for Windows 2 Specific features of Unitherm for Windows 3 Localization 3 Graphical user interface of Unitherm for Windows 4 The main ... mode. ... The window is opened with the List of reactions command of the Unitherm Reaction menu. ...

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• http://www.geol.msu.ru/deps/geochems/soft/en/Ab_An.doc
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... Ëàáîðàòîðèÿ òåîðåòè÷åñêîé áèîôèçèêè . ... This PyMol script is capable of generating a set of a molecule?s conformations, which can be further used to calculate their potential energy or any other properties. The script enables one to vary several internal degrees of freedom (DOFs) synchronously as well as scanning over a multidimensional grid in a space of DOFs. ... Íåò êîììåíòàðèåâ " PyMol script for scanning potential energy surfaces " . ... 2013 ERG Research Group . ...

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• Using Firefly/GAMESS-US efficiently ERG Research Group: Ëàáîðàòîðèÿ
• Constructing discrete Laplacian via sparse matrix ERG Research Group:
• Normal modes visualization for PyMol ERG Research Group: Ëàáîðàòîðèÿ

... Ab initio calculations on several low lying excited electronic states of the OsO4 molecule and the isoelectronic IrO4+ are performed within the quasirelativistic effective core potential approach. ... The corresponding transition energy in OsO4 is estimated to be 34575 cm-1; this value is in excellent agreement with the experimentally observed energy 35000 cm-1 The spin-orbit splitting for all the states mentioned above are found to be rather small. Coordination Chemistry Laboratory ...

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• Molecular mechanics calculations of beta-diketonate, aqua, and
• Thermodynamic calculation of yttrium-barium-copper-oxygen phase diagram
• Moscow University Chemistry Bulletin Vol. 51, No. 1, P. 27 (2010)

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Google as a taxonomic engine Alexey Shipunov Background: tree cow mouse rat Background: Google Scholar · · · · · · · Extract phyla names Obtain numbers of joint hits Do some magic Calculate similarity Make clusters Same, with - ecology Same, with classes names Numbers of joint hits · · · · · Phyla names from my synat classification R script to ...

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... Ïîëíàÿ âåðñèÿ ýòîé ñòðàíèöû: Cortex Command . Ñòóäåí÷åñêèé ôîðóì Ôèçôàêà ÌÃÓ > Îáùèé > Âñå îáî âñåì > Þìîð, ðàçâëå÷åíèÿ, èãðóøêè.. ... Åñëè âîçíèêëà íåîáõîäèìîñòü óáèòü íåêîòîðîå êîëè÷åñòâî âðåìåíè - Cortex Command ýòî òî, ÷òî íóæíî. ... 21.1.2008, 21:44 . ... Äëÿ ïðîñìîòðà ïîëíîé âåðñèè ýòîé ñòðàíèöû, ïîæàëóéñòà, ïðîéäèòå ïî ññûëêå . Ðóññêàÿ âåðñèÿ IP.Board 2001-2016 IPS, Inc. ...

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• Time likely to end within 5 billion years, physicists calculate - Ñòóäåí÷åñêèé
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Open Conference Systems . Conference Help . ... Password . ... Conference Content Search . All Authors Title Abstract Index terms Full Text . Conference Information . ... Home . ... Account . ... Current Conferences . Home > Reset Password . For security reasons, this system emails a reset password to registered users, rather than recalling the current password. Enter your email address below to reset your password. A confirmation will be sent to this email address. ...

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... VaST is a software tool for finding variable objects on a series of astronomical images. ... VaST performs object detection and aperture photometry using SExtractor on each image, cross-matches lists of detected stars, performs magnitude calibration with respect to the first (reference) image and constructs a lightcurve for each object. ... VaST FITS image viewer ./pgfv . ... Part I" PZP, vol. ... K. V. Sokolovsky, S. A. Korotkiy; "New Variable Stars Discovered by the NMW Survey" PZP, vol. ...

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... Brykina I. G. Methods for calculation of heat transfer and skin friction in 3D hypersonic laminar flow over bodies at all Reynolds numbers. ... Sakharov V. I. Simulation of nonequilibrium viscous gas flows in induction plasmatrons and over bodies. ... Shcherbak V. G. Numerical study of nonequilibrium air flow over bodies. ... Tirskiy G. A. Destruction of solid bodies in the hypersonic gas flow. ... Rusakov V. V. Analytical and numerical investigation of 3D viscous flow over blunt bodies. ...

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... Opening of the educational programme - School of CEOs, "Capsule of security" for the key managers of Bashneft Group. 2013/04/02 - 4:30pm . ... Higher School of Management and Innovation (Faculty of Lomonosov MSU) was founded in June 2006 by the Academic Council on the initiative of the Moscow State University Rector, academician V.A. Sadovnichiy and Chairman of the Board of Directors of JSFC "Sistema" V.P. Yevtushenko. ... MSU website . ... 2006-2016 MSU Higher School of Management and Innovation. ...

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... Supercomputing Technologies in Science, Education and Industry Almanac Series . ... Technological Institute for Superhard and Novel Carbon Materials . ... Therefore, in solving the problems will be applied as specialized methods for the study of polyatomic structures - the method of empirical potentials Brenner . ... AREA: Condensed Matter Physics, Theoretical Physics, Physical Chemistry . ... Moscow State Uiversity . ... Research Computing Center (RCC) of Lomonosov Moscow State University . ...

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• Welcome to GES Journal

Arushanyan O.B., Volchenskova N.I., Zaletkin S.F. Calculation of expansion coefficients of series in Chebyshev polynomials for a solution to a Cauchy problem // Moscow University Mathematics Bulletin.2012. ... 211-216. ... The solution of such a system and its derivatives are expanded in shifted series in Chebyshev polynomials of the first kind. Algorithms to determine the expansion coefficients are described. ...

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• V.B.Semikoz, D.D.Sokoloff, J.W.F. Valle, Lepton asymmetries and primordial
• Semikoz V. B., Sokoloff D., Valle J.W.F. Lepton asymmetries and primordial

Sign in Register . ... Resources . ... Blog . 495) 3334-65-56 . info@ecfs.msu.ru . All contacts . ... E-mail * . Password * . ... Confirm password * . ... The e-mail address is not made public and will only be used if you wish to receive a new password or wish to receive certain news or notifications by e-mail. Provide a password for the new account in both fields. ... Contacts . The Department of land resources . ...

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... It is possible to direct the immune system to attack cancer cells. This can be done because of the presence of foreign proteins inside cancer cells. ... Mutation density in cancer cells The chance of finding an immunogenic peptide among all neutral foreign peptides for a mutation-rich cancer is higher than that for a cancer with fewer mutations. ... The final step is the CD8+ cell that kills the cells showing foreign peptides on their surface. ... Calculate the processing score for each peptide. ...

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• MCCMB'15 - OpenConf Peer Review & Conference Management System

Predictor of DVM-program performance . User's guide . ... With the predictor user can get the predicted time characteristics of execution of his program on MPP or workstation cluster in more or less details. The predictor is the system for processing the trace information gathered by DVM-program Run-Time system (Lib-DVM library) during the program execution on a workstation and consists of two major components: trace interpreter ( PRESAGE) and time estimator (RATER). ... Program execution. ...

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• Fortran DVM compiler. User's guide
• Debugging DVM-program. User's guide. Part 1

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