Literatura académica sobre el tema "Functional molecules"
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Artículos de revistas sobre el tema "Functional molecules"
Archut, Andreas y Fritz Vögtle. "Functional cascade molecules". Chemical Society Reviews 27, n.º 4 (1998): 233. http://dx.doi.org/10.1039/a827233z.
Texto completoMayo, Kevin H. "Heterologous Interactions with Galectins and Chemokines and Their Functional Consequences". International Journal of Molecular Sciences 24, n.º 18 (14 de septiembre de 2023): 14083. http://dx.doi.org/10.3390/ijms241814083.
Texto completoAbbaz, Tahar, Amel Bendjeddou y Didier Villemin. "Molecular structure, NBO analysis, first hyper polarizability, and homo-lumo studies of π-extended tetrathiafulvalene (EXTTF) derivatives connected to π-nitro phenyl by density functional method". International Journal of Advanced Chemistry 6, n.º 1 (5 de junio de 2018): 114. http://dx.doi.org/10.14419/ijac.v6i1.11126.
Texto completoSimpson, Jeremy C. y Arwyn T. Jones. "Early endocytic Rabs: functional prediction to functional characterization." Biochemical Society Symposia 72 (1 de enero de 2005): 99–108. http://dx.doi.org/10.1042/bss0720099.
Texto completoMaslehat, Sholeh, Soroush Sardari y Mahboube Ganji Arjenaki. "Frequency and Importance of Six Functional Groups that Play a Role in Drug Discovery". Biosciences, Biotechnology Research Asia 15, n.º 3 (27 de septiembre de 2018): 541–48. http://dx.doi.org/10.13005/bbra/2659.
Texto completoNiemeyer, Jochen y Noel Pairault. "Chiral Mechanically Interlocked Molecules – Applications of Rotaxanes, Catenanes and Molecular Knots in Stereoselective Chemosensing and Catalysis". Synlett 29, n.º 06 (26 de febrero de 2018): 689–98. http://dx.doi.org/10.1055/s-0036-1591934.
Texto completoValášek, Michal, Marcin Lindner y Marcel Mayor. "Rigid multipodal platforms for metal surfaces". Beilstein Journal of Nanotechnology 7 (8 de marzo de 2016): 374–405. http://dx.doi.org/10.3762/bjnano.7.34.
Texto completoWatve, Milind. "How many functional molecules ?" Resonance 2, n.º 7 (julio de 1997): 86–87. http://dx.doi.org/10.1007/bf02838596.
Texto completoBarik, Debashis, Geethanjali Anand, Subba Rao Cheekatla y Mintu Porel. "A Novel Class of Functionally Tuneable Star-Shaped Molecules for Interaction with Multiple Proteins". Organics 4, n.º 2 (16 de mayo de 2023): 219–31. http://dx.doi.org/10.3390/org4020018.
Texto completoSplitter, Gary A. "Molecular and functional properties of leucocyte surface molecules". Veterinary Immunology and Immunopathology 35 (febrero de 1993): 11–15. http://dx.doi.org/10.1016/0165-2427(93)90127-p.
Texto completoTesis sobre el tema "Functional molecules"
Laming, Gregory John. "Density functional theory for molecules". Thesis, University of Cambridge, 1994. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.336907.
Texto completoJenny, Nicolas [Verfasser]. "Synthesis of New Functional Molecules for Molecular Electronics / Nicolas Jenny". München : Verlag Dr. Hut, 2012. http://d-nb.info/1026652278/34.
Texto completoOlaoye, Olufemi Opeyemi. "Density functional calculation of simple molecules". Thesis, Stellenbosch : Stellenbosch University, 2012. http://hdl.handle.net/10019.1/20345.
Texto completoAFRIKAANSE OPSOMMING: Berekeninge met Density Functional Theory (DFT) is ’n nuttige tegniek om die dinamika van molekules op potensiële energievlakke te verstaan. Beginnende met ’n prototipe molekuul formaldimien, wat die kern vorm van die groter fotochromiese molekuul dithizonatophenyl kwik (DPM), word die modellering van die molekuul meer ingewikkeld tot laasgenoemde bestudeer kan word asook sy fotochromiese afgeleides wat vervanging van elektronryk en elektronarm radikale by orto, meta en para posisies van die phenyl ringe insluit. DFT berekeninge word met spektra van Absorpsiespektroskopie met UV en sigbare lig asook tyd opgeloste spektra, verkry dmv femtosekondespektroskopie, vergelyk. In pol^ere aprotiese, pol^ere protiese en nie-pol^ere oplosmiddels, isomeriseer die molekuul om die C=N dubbelbinding. Daar kan tussen die twee isomere onderskei word deur dat die een in oplossing in sy grondtoestand blou en die ander een oranje voorkom. Die isomerisering is’n fotogeinduseerde proses. Die optimering van die molekul^ere struktuur, absorpsiespektra, oplosmiddel-afhanklikheid, en potensiële energievlak metings van die molekuul word bestudeer. Die sterk/swak wisselwerking wat in pol^ere protiese/aprotiese oplosmiddels verskyn word geopenbaar deur die hoe/lae absorpsie van die sekond^ere bande van die molekules. Daar is gevind dat die absorpsiespektra van DPM bathochromies in oplosmiddels met hoë diëlektriese konstantes is. Vir die potensiële energievlak berekeninge van die grondtoestand word rigiede en ontspanne metodes gebruik waar laasgenoemde met gebroke simmetrie berekeninge verkry word. Van alle metodes wat vir berekeninge gebruik was, gee die B3LYP/CEP-31G metode die beste benadering aan eksperimentele data. Alle berekeninge word gedoen met twee bekende sagteware pakkette; Amsterdam Density Functional (ADF) en Gaussian, wat op twee verskillende DFT metodes gebaseer is.
ENGLISH ABSTRACT: Density functional theory is a useful computational tool in the understanding of molecular dynamics on potential energy surfaces. Starting with a prototype molecule formaldimine, the photochromic molecule dithizonatophenylmercury II (DPM) and a set of its photochromic derivatives, (involving substitutions of electron donating and electron withdrawing substituents at ortho, meta and para positions of the dithizonato phenyl rings), are studied through density functional calculation in comparison with steady state absorption spectra obtained from UV-Visible and femto second spectroscopy experiments. In polar aprotic, polar protic and non-polar solvents these molecules isomerise around C=N double bond chromophore, from orange electronic ground states to blue electronic ground states upon photo-excitation. We investigate the structural optimisations, the absorption spectra, the solvent dependence and the potential energy surface (PES) of these molecules. The strong (weak) interactions exhibited by the polar protic (aprotic) solvents used are revealed through high (low) absorbance in the secondary bands of these molecules. The absorption spectra of DPM are found to be bathochromic in solvents with high dielectric constants. For the ground state PES calculation we make use of rigid and relaxed methods, and the latter is obtained through broken symmetry calculation. Of all the methods used in calculation, B3LYP/CEP-31G method gives the best approximation to the experimental data. All calculations are done using the two renown software, Amsterdam Density Functional (ADF) and Gaussian, availing their different density functional methods.
Pace, Giuseppina. "Self-assembly of functional molecules at surfaces". Université Louis Pasteur (Strasbourg) (1971-2008), 2007. https://publication-theses.unistra.fr/public/theses_doctorat/2007/PACE_Giuseppina_2007.pdf.
Texto completoThis work is aimed at establishing a correlation between molecule-substrate and molecule-molecule interactions in view of the future implementation of nano-electronic devices based on unctional molecules. In particular, we studied the self-assembly behaviour of organic thiols functionalized molecules holding potential to act as switches on solid substrates. We focused on the isomerization of azobenzene based Self-Assembled Monolayers (SAMs) on gold substrates. A fine tuning of interchain interactions within the SAM made it possible to obtain high yield of isomerization. We also devised a new method to isolate individual functional molecules in a host SAM. In the final chapter we present our studies on the self-assembly properties of grid-like supramolecular architectures. Sub-molecularly resolved Scanning Tunneling Microscopy studies offered direct insights into structural and dynamic properties of the monolayers
Pace, Giuseppina Samori Paolo. "Self-assembly of functional molecules at surfaces". Strasbourg : Université Louis Pasteur, 2008. http://eprints-scd-ulp.u-strasbg.fr:8080/885/01/PACE_Giuseppina_2007.pdf.
Texto completoOda, Katsunari. "Synthetic studies on silicon-containing functional molecules". 京都大学 (Kyoto University), 2007. http://hdl.handle.net/2433/136238.
Texto completoKatzer, Frank. "Molecular genetic and functional analyses of surface molecules of Theileria annulata sporozoites". Thesis, University of York, 1995. http://etheses.whiterose.ac.uk/9778/.
Texto completoSahai, Erik Anand. "Functional analysis of RhoA and its effector molecules". Thesis, University College London (University of London), 1998. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.300839.
Texto completoCampitiello, Marilena <1983>. "Synthesis of Self-Assembling Molecules for Functional Materials". Doctoral thesis, Alma Mater Studiorum - Università di Bologna, 2017. http://amsdottorato.unibo.it/8165/1/Marilena%20Campitiello_Tesi.pdf.
Texto completoGatchell, Michael. "Molecular Hole Punching : Impulse Driven Reactions in Molecules and Molecular Clusters". Doctoral thesis, Stockholms universitet, Fysikum, 2016. http://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-129523.
Texto completoAt the time of the doctoral defense, the following paper was unpublished and had a status as follows: Paper 1: Submitted.
Libros sobre el tema "Functional molecules"
Wrigley, Stephen. Functional molecules from natural sources. Cambridge: Royal Society of Chemistry, 2011.
Buscar texto completoWrigley, Stephen K., Robert Thomas, Neville Nicholson y Colin Bedford, eds. Functional Molecules from Natural Sources. Cambridge: Royal Society of Chemistry, 2010. http://dx.doi.org/10.1039/9781849732079.
Texto completoWeitao, Yang, ed. Density-functional theory of atoms and molecules. New York: Oxford University Press, 1989.
Buscar texto completoE, Ellis D., ed. Density functional theory of molecules, clusters, and solids. Dordrecht: Kluwer Academic Publishers, 1995.
Buscar texto completoEllis, D. E., ed. Density Functional Theory of Molecules, Clusters, and Solids. Dordrecht: Springer Netherlands, 1996. http://dx.doi.org/10.1007/978-94-011-0487-6.
Texto completoE, Smith John y Chappell Leslie H, eds. Functional molecules on the surface of protozoan parasites. Cambridge, [England]: Cambridge University Press, 1994.
Buscar texto completoBritish Society for Parasitology. Symposium. Functional molecules on the surface of protozoan parasites. Editado por Smith John E. 1932- y Chappell L. H. Cambridge: Cambridge University Press, 1994.
Buscar texto completoEbata, Takayuki y Masaaki Fujii, eds. Physical Chemistry of Cold Gas-Phase Functional Molecules and Clusters. Singapore: Springer Singapore, 2019. http://dx.doi.org/10.1007/978-981-13-9371-6.
Texto completoThor, G. Bioprocesses of biopharmaceuticals: The obligatory role of post translational modifications to create functional bioactive molecules. Westborough, MA: D&MD Publications, 2005.
Buscar texto completoDoba, Takahiro. Iron-Catalyzed C-H/C-H Coupling for Synthesis of Functional Small Molecules and Polymers. Singapore: Springer Nature Singapore, 2023. http://dx.doi.org/10.1007/978-981-99-4121-6.
Texto completoCapítulos de libros sobre el tema "Functional molecules"
Cerofolini, Gianfranco. "Functional Molecules". En Nanoscale Devices, 83–93. Berlin, Heidelberg: Springer Berlin Heidelberg, 2009. http://dx.doi.org/10.1007/978-3-540-92732-7_7.
Texto completoCerofolini, Gianfranco. "Grafting Functional Molecules". En Nanoscale Devices, 95–130. Berlin, Heidelberg: Springer Berlin Heidelberg, 2009. http://dx.doi.org/10.1007/978-3-540-92732-7_8.
Texto completoArend, Giordana Demaman, Claudio Malaghini, Maicon S. N. dos Santos, Carolina E. Demaman Oro, Marcus V. Tres y Katia Rezzadori. "Functional Molecules Obtained by Membrane Technology". En Functional Meat Products, 181–92. New York, NY: Springer US, 2023. http://dx.doi.org/10.1007/978-1-0716-3573-5_14.
Texto completoGordan, Ovidiu D. y Dietrich R. T. Zahn. "Small Organic Molecules". En Ellipsometry of Functional Organic Surfaces and Films, 197–219. Berlin, Heidelberg: Springer Berlin Heidelberg, 2014. http://dx.doi.org/10.1007/978-3-642-40128-2_10.
Texto completoGordan, Ovidiu D. y Dietrich R. T. Zahn. "Small Organic Molecules". En Ellipsometry of Functional Organic Surfaces and Films, 295–317. Cham: Springer International Publishing, 2018. http://dx.doi.org/10.1007/978-3-319-75895-4_13.
Texto completoNarayan, Shoba. "Chitosan-Based Nanoformulation as Carriers of Small Molecules for Tissue Regeneration". En Functional Chitosan, 321–42. Singapore: Springer Singapore, 2019. http://dx.doi.org/10.1007/978-981-15-0263-7_11.
Texto completoFulde, P. "Density Functional Theory". En Electron Correlations in Molecules and Solids, 39–59. Berlin, Heidelberg: Springer Berlin Heidelberg, 1995. http://dx.doi.org/10.1007/978-3-642-57809-0_3.
Texto completoFulde, Peter. "Density Functional Theory". En Electron Correlations in Molecules and Solids, 39–59. Berlin, Heidelberg: Springer Berlin Heidelberg, 1993. http://dx.doi.org/10.1007/978-3-642-97477-9_3.
Texto completoFulde, P. "Density Functional Theory". En Electron Correlations in Molecules and Solids, 39–59. Berlin, Heidelberg: Springer Berlin Heidelberg, 1991. http://dx.doi.org/10.1007/978-3-642-97309-3_3.
Texto completoMartins, Natália, Maria Beatriz P. P. Oliveira y Isabel C. F. R. Ferreira. "Development of Functional Dairy Foods". En Bioactive Molecules in Food, 1377–95. Cham: Springer International Publishing, 2019. http://dx.doi.org/10.1007/978-3-319-78030-6_35.
Texto completoActas de conferencias sobre el tema "Functional molecules"
Mironyuk, V. N., M. A. Kasatkina, T. Ya Karatyshova, M. V. Gavrikov, A. I. Smirnova, N. V. Usoltseva y E. G. Glukhovskoy. "DFT STUDY OF THE ELECTRONIC PROPERTIES OF SYSTEMS BASED ON A3B-TYPE PORPHIN DERIVATIVE MOLECULES". En Actual problems of physical and functional electronics. Ulyanovsk State Technical University, 2023. http://dx.doi.org/10.61527/appfe-2023.139-141.
Texto completoPartoens, Bart. "Density functional theory approach to artificial molecules". En Density functional theory and its application to materials. AIP, 2001. http://dx.doi.org/10.1063/1.1390183.
Texto completoManion, Charles A., Ryan Arlitt, Irem Tumer, Matthew I. Campbell y P. Alex Greaney. "Towards Automated Design of Mechanically Functional Molecules". En ASME 2015 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. American Society of Mechanical Engineers, 2015. http://dx.doi.org/10.1115/detc2015-46078.
Texto completoKhazaee, Tina, Chris J. D. Norley, Hristo N. Nikolov, Steven I. Pollmann y David W. Holdsworth. "Micro-CT imaging technique to characterize diffusion of small-molecules". En Biomedical Applications in Molecular, Structural, and Functional Imaging, editado por Barjor S. Gimi y Andrzej Krol. SPIE, 2020. http://dx.doi.org/10.1117/12.2548624.
Texto completoKobayashi, Norihisa, Makoto Nishizawa, Shintarou Inoue y Kazuki Nakamura. "Streching of (DNA/functional molecules) complex between electrodes towards DNA molecular wire". En SPIE NanoScience + Engineering, editado por Norihisa Kobayashi, Fahima Ouchen y Ileana Rau. SPIE, 2009. http://dx.doi.org/10.1117/12.828210.
Texto completoChiba, Hiroshi, Yukiko Oshikubo, Keiji Watanabe, Takeshi Tokairin y Eishin Yamakawa. "Tribological Characteristics of Newly Synthesized Multi-Functional PFPE Lubricants". En World Tribology Congress III. ASMEDC, 2005. http://dx.doi.org/10.1115/wtc2005-63634.
Texto completoYin, Meng, Xiangyu Qiao, Qinqiang Zhang, Ken Suzuki y Lei Wang. "Strain-Induced Change of Adsorption Behaviour of Gas Molecules on Graphene Analyzed by Density Functional Method". En ASME 2022 International Mechanical Engineering Congress and Exposition. American Society of Mechanical Engineers, 2022. http://dx.doi.org/10.1115/imece2022-94892.
Texto completoHeilweil, E. J. "Population Lifetimes of OH(v=1) and OD(v=1) Vibrations in Alcohols, Silanols and Crystalline Micas". En International Conference on Ultrafast Phenomena. Washington, D.C.: Optica Publishing Group, 1986. http://dx.doi.org/10.1364/up.1986.wb3.
Texto completoMizuseki, Hiroshi, Nobuaki Igarashi, Rodion V. Belosludov, Amir A. Farajian y Yoshiyuki Kawazoe. "Genetic Algorithm Approach to Functional Molecules for Nanoscale Devices". En 2004 International Conference on Solid State Devices and Materials. The Japan Society of Applied Physics, 2004. http://dx.doi.org/10.7567/ssdm.2004.p8-4.
Texto completoCunningham, Connor, Srajan Pillai, Jeong Ho You, Jaehoon Ji y Jong Hyun Choi. "Photo-Switchable Optical Property of Two-Dimensional Transition Metal Dichalcogenides". En ASME 2023 International Mechanical Engineering Congress and Exposition. American Society of Mechanical Engineers, 2023. http://dx.doi.org/10.1115/imece2023-111520.
Texto completoInformes sobre el tema "Functional molecules"
Burke, Kieron. Density Functional Theory with Dissipation: Transport through Single Molecules. Office of Scientific and Technical Information (OSTI), abril de 2012. http://dx.doi.org/10.2172/1039302.
Texto completoBartlett, Rodney J. y Anthony Yau. New AB Initio Based Density Functional Methods for Molecules, Polymers, and Crystals. Fort Belvoir, VA: Defense Technical Information Center, mayo de 2000. http://dx.doi.org/10.21236/ada383087.
Texto completoRon, Eliora y Eugene Eugene Nester. Global functional genomics of plant cell transformation by agrobacterium. United States Department of Agriculture, marzo de 2009. http://dx.doi.org/10.32747/2009.7695860.bard.
Texto completoLeygue, Etienne R. Mammaglobin and Lipophilin Related Molecules in Normal and Tumor Human Breast Tissue: Expression Hormone Regulation and Functional Analysis. Fort Belvoir, VA: Defense Technical Information Center, agosto de 2004. http://dx.doi.org/10.21236/ada430357.
Texto completoMyneni, Satish, C. In-situ Evaluation of Soil Organic Molecules: Functional Group Chemistry Aggregate Structures, Metal & Surface Complexation Using Soft X-Ray. Office of Scientific and Technical Information (OSTI), noviembre de 2008. http://dx.doi.org/10.2172/942132.
Texto completoYue, Xiaoshan y Amanda B. Hummon. Proteomic Analysis to Identify Functional Molecules in Drug Resistance Caused by E-Cadherin Knockdown in 3D-Cultured Colorectal Cancer Models. Fort Belvoir, VA: Defense Technical Information Center, septiembre de 2013. http://dx.doi.org/10.21236/ada599355.
Texto completoMatthews, Lisa, Guanming Wu, Robin Haw, Timothy Brunson, Nasim Sanati, Solomon Shorser, Deidre Beavers, Patrick Conley, Lincoln Stein y Peter D'Eustachio. Illuminating Dark Proteins using Reactome Pathways. Reactome, octubre de 2022. http://dx.doi.org/10.3180/poster/20221027matthews.
Texto completoMcClure, Michael A., Yitzhak Spiegel, David M. Bird, R. Salomon y R. H. C. Curtis. Functional Analysis of Root-Knot Nematode Surface Coat Proteins to Develop Rational Targets for Plantibodies. United States Department of Agriculture, octubre de 2001. http://dx.doi.org/10.32747/2001.7575284.bard.
Texto completoChamovitz, Daniel A. y Zhenbiao Yang. Chemical Genetics of the COP9 Signalosome: Identification of Novel Regulators of Plant Development. United States Department of Agriculture, enero de 2011. http://dx.doi.org/10.32747/2011.7699844.bard.
Texto completoSosa Munguía, Paulina del Carmen, Verónica Ajelet Vargaz Guadarrama, Marcial Sánchez Tecuatl, Mario Garcia Carrasco, Francesco Moccia y Roberto Berra-Romani. Diabetes mellitus alters intracellular calcium homeostasis in vascular endothelial cells: a systematic review. INPLASY - International Platform of Registered Systematic Review and Meta-analysis Protocols, mayo de 2022. http://dx.doi.org/10.37766/inplasy2022.5.0104.
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