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Статті в журналах з теми "Computational calculation"
Kelley, Jason, and Chad Higgins. "Computational efficiency for the surface renewal method." Atmospheric Measurement Techniques 11, no. 4 (April 16, 2018): 2151–58. http://dx.doi.org/10.5194/amt-11-2151-2018.
Повний текст джерелаLiu, Dingjin, Bo Li, and Guofeng Liu. "Calculation of Surface Offset Gathers Based on Reverse Time Migration and Its Parallel Computation with Multi-GPUs." Applied Sciences 11, no. 22 (November 12, 2021): 10687. http://dx.doi.org/10.3390/app112210687.
Повний текст джерелаPyatkin, P. A., and E. G. Skibin. "ACCOUNT THE INFLUENCE OF DEFORMATIONS FROM PART-TIME WORK OF THE TERRITORY ON THE STRESS-STRAIN STATE OF BUILDING STRUCTURES." Construction and Geotechnics 12, no. 3 (December 15, 2021): 53–62. http://dx.doi.org/10.15593/2224-9826/2021.3.06.
Повний текст джерелаMaahury, Mirella Fonda. "MOLECULAR STRUCTURE AND ELECTRONIC PROPERTIES OF EUGENOL AND ITS ANALOGUES USING DFT." JURNAL KIMIA MULAWARMAN 19, no. 2 (May 31, 2022): 58. http://dx.doi.org/10.30872/jkm.v19i2.1123.
Повний текст джерелаBraatz, R. P., P. M. Young, J. C. Doyle та M. Morari. "Computational complexity of μ calculation". IEEE Transactions on Automatic Control 39, № 5 (травень 1994): 1000–1002. http://dx.doi.org/10.1109/9.284879.
Повний текст джерелаEbeling, John C., Ian C. Bacon, Trent P. Bates, Scott D. Sommerfeldt, and Jonathan D. Blotter. "Improved efficiency of vibration-based sound power computation through multi-layered radiation resistance matrix symmetry." Journal of the Acoustical Society of America 151, no. 4 (April 2022): A228. http://dx.doi.org/10.1121/10.0011146.
Повний текст джерелаKrejsa, Martin, and Juraj Kralik. "Probabilistic Computational Methods in Structural Failure Analysis." Journal of Multiscale Modelling 06, no. 03 (September 2015): 1550006. http://dx.doi.org/10.1142/s1756973715500067.
Повний текст джерелаQin, Xinming, Honghui Shang, Lei Xu, Wei Hu, Jinlong Yang, Shigang Li, and Yunquan Zhang. "The static parallel distribution algorithms for hybrid density-functional calculations in HONPAS package." International Journal of High Performance Computing Applications 34, no. 2 (May 9, 2019): 159–68. http://dx.doi.org/10.1177/1094342019845046.
Повний текст джерелаTokarev, Vyacheslav, and Nikolay Novitsky. "The method of adjustment of heat supply systems with the multistage temperature control at pumping stations." MATEC Web of Conferences 212 (2018): 02006. http://dx.doi.org/10.1051/matecconf/201821202006.
Повний текст джерелаPlatov, Alexander J., and Juri I. Platov. "Efficient computation of ship’s wave-making resistance using michell’s integral." Russian Journal of Water Transport, no. 73 (December 20, 2022): 206–15. http://dx.doi.org/10.37890/jwt.vi73.327.
Повний текст джерелаДисертації з теми "Computational calculation"
Da, Ronch Andrea. "On the calculation of dynamic derivatives using computational fluid dynamics." Thesis, University of Liverpool, 2012. http://livrepository.liverpool.ac.uk/5513/.
Повний текст джерелаBrown, Kieron David. "Computational analysis of low speed axial flow rotors." Thesis, University of Bristol, 1998. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.389158.
Повний текст джерелаTang, Xiao. "Computational investigation of 2D functional materials for nanoelectronics." Thesis, Queensland University of Technology, 2020. https://eprints.qut.edu.au/206075/1/Xiao_Tang_Thesis.pdf.
Повний текст джерелаAlmlöf, Martin. "Computational Methods for Calculation of Ligand-Receptor Binding Affinities Involving Protein and Nucleic Acid Complexes." Doctoral thesis, Uppsala University, Department of Cell and Molecular Biology, 2007. http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-7421.
Повний текст джерелаThe ability to accurately predict binding free energies from computer simulations is an invaluable resource in understanding biochemical processes and drug action. Several methods based on microscopic molecular dynamics simulations exist, and in this thesis the validation, application, and development of the linear interaction energy (LIE) method is presented.
For a test case of several hydrophobic ligands binding to P450cam it is found that the LIE parameters do not change when simulations are performed with three different force fields. The nonpolar contribution to binding of these ligands is best reproduced with a constant offset and a previously determined scaling of the van der Waals interactions.
A new methodology for prediction of binding free energies of protein-protein complexes is investigated and found to give excellent agreement with experimental results. In order to reproduce the nonpolar contribution to binding, a different scaling of the van der Waals interactions is neccesary (compared to small ligand binding) and found to be, in part, due to an electrostatic preorganization effect not present when binding small ligands.
A new treatment of the electrostatic contribution to binding is also proposed. In this new scheme, the chemical makeup of the ligand determines the scaling of the electrostatic ligand interaction energies. These scaling factors are calibrated using the electrostatic contribution to hydration free energies and proposed to be applicable to ligand binding.
The issue of codon-anticodon recognition on the ribosome is adressed using LIE. The calculated binding free energies are in excellent agreement with experimental results, and further predict that the Leu2 anticodon stem loop is about 10 times more stable than the Ser stem loop in complex with a ribosome loaded with the Phe UUU codon. The simulations also support the previously suggested roles of A1492, A1493, and G530 in the codon-anticodon recognition process.
Almlöf, Martin. "Computational methods for calculation of Ligand-Receptor binding affinities involving protein and nucleic acid complexes /." Uppsala : Acta Universitatis Upsaliensis, 2007. http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-7421.
Повний текст джерелаFey, Natalie. "Molecular modelling of ferrocenes and arylphosphines." Thesis, Keele University, 2001. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.368982.
Повний текст джерелаFosso-Tande, Jacob. "A Computational Chemistry Study of Spin Traps." Digital Commons @ East Tennessee State University, 2007. https://dc.etsu.edu/etd/2127.
Повний текст джерелаTang, Cheng. "Computational exploration of two-dimensional materials with novel electronic, optical and magnetic properties." Thesis, Queensland University of Technology, 2021. https://eprints.qut.edu.au/212532/1/Cheng_Tang_Thesis.pdf.
Повний текст джерелаParasuram, Priya Laity John H. "Homologous modeling and structure calculation of the MTF-1 zinc finger domain protein using NMR and computational techniques." Diss., UMK access, 2006.
Знайти повний текст джерела"A thesis in computer science." Typescript. Advisor: John H. Laity. Vita. Title from "catalog record" of the print edition Description based on contents viewed Nov. 1, 2007. Includes bibliographical references (leaves 81-88). Online version of the print edition.
Castro, Aguilera Abril Carolina. "Computational study of nuclear magnetic shielding constants." Doctoral thesis, Universitat de Girona, 2017. http://hdl.handle.net/10803/565597.
Повний текст джерелаL’espectroscòpia de Ressonància Magnètica Nuclear (RMN) és una eina indispensable en el modern arsenal de químics analítics i biòlegs estructurals.La present tesi és un estudi computacional dels desplaçaments químics de RMN en un nombre de compostos químics d’interès, usant aproximacions estàtiques i dinàmiques mitjançant la teoria del funcional de la densitat, la qual ajudarà a predir, a confirmar i/o a complementar dades obtingudes experimentalment. S’ha donat especial atenció en casos on existeixen fortes interaccions substrat-solvent. Addicionalment, aquesta tesi aborda altres problemes metodològics que afecten la qualitat dels desplaçaments químics teòrics com el nivell de teoria, la inclusió explícita de molècules de solvent, l’elecció de la molècula de referència, així com els efectes relativistes en compostos que contenen àtoms pesats
Книги з теми "Computational calculation"
Caughey, D. A. Multigrid calculation of three-dimensional turbomachinery flows. Ithaca, New York: Fluid Dynamics and Aerodynamics Program, Sibley School of Mechanical and Aerospace Engineering, Cornell University, 1989.
Знайти повний текст джерелаNonlinear computational structural mechanics: New approaches and non-incremental methods of calculation. New York: Springer, 1999.
Знайти повний текст джерелаSpline functions: Computational methods. Philadelphia: Society for Industrial and Applied Mathematics, 2015.
Знайти повний текст джерелаG, Habashi W., ed. Advances in computational transonics. Swansea, U.K: Pineridge Press, 1985.
Знайти повний текст джерелаComputational statistical mechanics. Amsterdam: Elsevier, 1991.
Знайти повний текст джерелаR, Liu G., Tan V. B. C, and Han X, eds. Computational methods. Dordrecht: Springer, 2006.
Знайти повний текст джерелаMavriplis, Dimitri J. Unstructured mesh algorithms for aerodynamic calculations. Hampton, Va: Institute for Computer Applications in Science and Engineering, 1992.
Знайти повний текст джерелаJoint, ASME/SES Applied Mechanics and Engineering Sciences Conference (1988 Berkeley Calif ). Computational probabilistic methods. New York, N.Y. (345 E. 47th St., New York 10017): American Society of Mechanical Engineers, 1988.
Знайти повний текст джерелаInstitute Of Electrical and Electronics Engineers. IEEE computational science & engineering. Los Alamitos, CA: IEEE Computer Society, 1994.
Знайти повний текст джерелаG, Cox M., Hammarling S. J, and Wilkinson J. H, eds. Reliable numerical computation. Oxford: Clarendon Press, 1990.
Знайти повний текст джерелаЧастини книг з теми "Computational calculation"
Onishi, Taku. "Atomic Orbital Calculation." In Quantum Computational Chemistry, 89–112. Singapore: Springer Singapore, 2017. http://dx.doi.org/10.1007/978-981-10-5933-9_7.
Повний текст джерелаRoh, Myung-Il, and Kyu-Yeul Lee. "Calculation of Freeboard." In Computational Ship Design, 105–33. Singapore: Springer Singapore, 2017. http://dx.doi.org/10.1007/978-981-10-4885-2_9.
Повний текст джерелаGlock, H. W., K. Rothemund, and U. van Rienen. "Coupled Calculation of Eigenmodes." In Computational Electromagnetics, 85–101. Berlin, Heidelberg: Springer Berlin Heidelberg, 2003. http://dx.doi.org/10.1007/978-3-642-55745-3_7.
Повний текст джерелаFernández, Francisco M., and Julián Echave. "Nonadiabatic Calculation of Dipole Moments." In Computational Spectroscopy, 173–99. Weinheim, Germany: Wiley-VCH Verlag GmbH & Co. KGaA, 2010. http://dx.doi.org/10.1002/9783527633272.ch6.
Повний текст джерелаHenderson, Thomas C. "Coordinate Frames and Gradient Calculation." In Computational Sensor Networks, 1–17. Boston, MA: Springer US, 2009. http://dx.doi.org/10.1007/978-0-387-09643-8_4.
Повний текст джерелаLent, Craig S. "Calculation of Transport Through Ballistic Quantum Structures." In Computational Electronics, 259–62. Boston, MA: Springer US, 1991. http://dx.doi.org/10.1007/978-1-4757-2124-9_53.
Повний текст джерелаZhang, K. X., and J. N. Zhang. "Numerov Calculation of AlxGa1-xN/GaN Heterostructure." In Computational Mechanics, 307. Berlin, Heidelberg: Springer Berlin Heidelberg, 2007. http://dx.doi.org/10.1007/978-3-540-75999-7_107.
Повний текст джерелаMafra, Luís, Sérgio Santos, Mariana Sardo, and Heather Frericks Schmidt. "Calculation of NMR Tensors." In Computational Pharmaceutical Solid State Chemistry, 287–329. Hoboken, NJ: John Wiley & Sons, Inc, 2016. http://dx.doi.org/10.1002/9781118700686.ch12.
Повний текст джерелаOnishi, Taku. "Molecular Orbital Calculation of Diatomic Molecule." In Quantum Computational Chemistry, 113–57. Singapore: Springer Singapore, 2017. http://dx.doi.org/10.1007/978-981-10-5933-9_8.
Повний текст джерелаMorokuma, K., U. Nagashima, S. Yamamoto, N. Koga, S. Obara, and S. Yabushita. "Chemical Calculation on Japanese Supercomputers." In Methods in Computational Chemistry, 147–65. Boston, MA: Springer US, 1990. http://dx.doi.org/10.1007/978-1-4615-7416-3_3.
Повний текст джерелаТези доповідей конференцій з теми "Computational calculation"
Braatz, Richard D., Peter M. Young, John C. Doyle та Manfred Morari. "Computational complexity of μ calculation". У 1993 American Control Conference. IEEE, 1993. http://dx.doi.org/10.23919/acc.1993.4793162.
Повний текст джерелаVeras, T. M. L. de, A. F. Ramos, R. J. G. B. de Queiroz, and A. G. de Oliveira. "Calculation of Fundamental Groups via Computational Paths." In Encontro de Teoria da Computação. Sociedade Brasileira de Computação - SBC, 2021. http://dx.doi.org/10.5753/etc.2021.16370.
Повний текст джерелаJankowski, Eric. "Computational challenges in nanoparticle partition function calculation." In the 1st Conference of the Extreme Science and Engineering Discovery Environment. New York, New York, USA: ACM Press, 2012. http://dx.doi.org/10.1145/2335755.2335822.
Повний текст джерелаKaneko, Toshiaki. "Numerical calculation of one-loop integration." In 3rd Computational Particle Physics Workshop. Trieste, Italy: Sissa Medialab, 2011. http://dx.doi.org/10.22323/1.131.0010.
Повний текст джерелаBühler, Simon, Douglas Wilcox, Joris P. Oosterhuis, and Theo H. Van der Meer. "Calculation of thermoacoustic functions with computational fluid dynamics." In ICA 2013 Montreal. ASA, 2013. http://dx.doi.org/10.1121/1.4799088.
Повний текст джерелаIsbasoiu, Eliza Consuela. "Services for Numerical Calculation." In 2009 International Conference on Computational Intelligence, Modelling and Simulation. IEEE, 2009. http://dx.doi.org/10.1109/cssim.2009.35.
Повний текст джерелаVierendeels, Jan, Kris Riemslagh, Erik Dick, Jan Vierendeels, Kris Riemslagh, and Erik Dick. "Flow calculation in complex shaped moving domains." In 13th Computational Fluid Dynamics Conference. Reston, Virigina: American Institute of Aeronautics and Astronautics, 1997. http://dx.doi.org/10.2514/6.1997-2044.
Повний текст джерелаShen, Ziang, Xinlei Chen, and Changqing Gu. "RCS Calculation of Dynamic Target." In 2018 International Applied Computational Electromagnetics Society Symposium - China (ACES). IEEE, 2018. http://dx.doi.org/10.23919/acess.2018.8669149.
Повний текст джерелаYoon, Seokkwan. "Calculation of Supersonic Combustion Using Implicit Schemes." In 16th AIAA Computational Fluid Dynamics Conference. Reston, Virigina: American Institute of Aeronautics and Astronautics, 2003. http://dx.doi.org/10.2514/6.2003-3546.
Повний текст джерелаWeiss, Jonathan. "Calculation of reacting flowfields involving stiff chemical kinetics." In 14th Computational Fluid Dynamics Conference. Reston, Virigina: American Institute of Aeronautics and Astronautics, 1999. http://dx.doi.org/10.2514/6.1999-3369.
Повний текст джерелаЗвіти організацій з теми "Computational calculation"
Koski, J. A., S. D. Wix, and J. K. Cole. Calculation of shipboard fire conditions for radioactive materials packages with the methods of computational fluid dynamics. Office of Scientific and Technical Information (OSTI), September 1997. http://dx.doi.org/10.2172/537283.
Повний текст джерелаKhrushch, Nila, Pavlo Hryhoruk, Tetiana Hovorushchenko, Sergii Lysenko, Liudmyla Prystupa, and Liudmyla Vahanova. Assessment of bank's financial security levels based on a comprehensive index using information technology. [б. в.], October 2020. http://dx.doi.org/10.31812/123456789/4474.
Повний текст джерелаBrown, Forrest B. Advanced Computational Methods for Monte Carlo Calculations. Office of Scientific and Technical Information (OSTI), January 2018. http://dx.doi.org/10.2172/1417155.
Повний текст джерелаGoldstein, Justin, Charles Hammock, Ralph Liu, Jacob Janz, Clyburn Cunningham, and Mitchell Rimerman. Offloading Calculations to Computational Storage Devices: Spark and HDFS. Office of Scientific and Technical Information (OSTI), August 2021. http://dx.doi.org/10.2172/1813800.
Повний текст джерелаWissink, Andrew, Jude Dylan, Buvana Jayaraman, Beatrice Roget, Vinod Lakshminarayan, Jayanarayanan Sitaraman, Andrew Bauer, James Forsythe, Robert Trigg, and Nicholas Peters. New capabilities in CREATE™-AV Helios Version 11. Engineer Research and Development Center (U.S.), June 2021. http://dx.doi.org/10.21079/11681/40883.
Повний текст джерелаHaehnel, Robert, Scott Christensen, J. Whitlow, Andrew Bauer, Ari Meyer, Gautham Rangarajan, Yonghu Wenren, et al. A computational prototyping environment interface for DoD CREATE™-AV Helios simulations. Engineer Research and Development Center (U.S.), May 2021. http://dx.doi.org/10.21079/11681/40582.
Повний текст джерелаHinkins, R. L. Parallel computation of automatic differentiation applied to magnetic field calculations. Office of Scientific and Technical Information (OSTI), September 1994. http://dx.doi.org/10.2172/10107439.
Повний текст джерелаPulay, Peter. Computationally Efficient Models for the Calculation of Structures and Properties of Materials. Fort Belvoir, VA: Defense Technical Information Center, March 1998. http://dx.doi.org/10.21236/ada343620.
Повний текст джерелаMitchell, Scott A., Mohamed Salah Ebeida, Vicente J. Romero, Laura Painton Swiler, Ahmad A. Rushdi, and Ahmad Abdelkader. Efficient Probability of Failure Calculations for QMU using Computational Geometry LDRD 13-0144 Final Report. Office of Scientific and Technical Information (OSTI), September 2015. http://dx.doi.org/10.2172/1221522.
Повний текст джерелаRittmann, P. D. Emergency Doses (ED) - Revision 3: A calculator code for environmental dose computations. Office of Scientific and Technical Information (OSTI), December 1990. http://dx.doi.org/10.2172/6040411.
Повний текст джерела