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Now showing items 5922-5941 of 6421
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Theoretical studies of chemical dynamics in complex systems: Nanoconfined water, microdroplets, biomolecular hydration layer, and water-mediated protein association
The thesis contains theoretical studies of the structure and dynamics in different complex systems. Depending on the systems and properties of interest we divide the thesis into five parts. In the first part, we study ... -
Theoretical Studies Of Electronic Excitation Energy Transfer Involving Some Nanomaterials
(2013-10-21)Electronic Excitation Energy Transfer is an important intermolecular photophysical process that can affect the excited state lifetime of a chromophore. A molecule in an electronically excited state can return to the ground ... -
Theoretical Studies Of Electronic Properties And Electronic Processes In Conjugated Molecules
(2011-07-08)This thesis deals with theoretical studies of electronic properties of organic conjugated molecules. The first chapter introduces different classes of organic conjugated molecules which possess high hole mobility, large ... -
Theoretical Studies of Energy Transport in Complex Systems
(2018-05-09)Photosynthesis involves the absorption of photons by light-harvesting pigments and the subsequent transfer of excitation from the absorption centre to the reaction centre. This highly efficient phenomenon of excitation ... -
Theoretical Studies Of Fullerenes And Fullerene Derivatives
(Indian Institute of Science, 2005-04-29)The detection of Ceo and Cro in 1985 and the subsequent development of a preparative procedure have opened up a new area of research in carbon chemistry. The study of physico-chemical properties of these molecules is ... -
Theoretical Studies Of pie-Facial Selectivity In Organic Reactions
(Indian Institute of Science, 2005-06-15)he thesis entitled "Theoretical Studies of pie-Facial Selectivity in Organic Reactions" involve a computational examination of a suitable reactivity problem in organic chemistry. Systematic and efficient -procedures have ... -
Theoretical Studies of Polymer Dynamics in Confined Spaces
The growing use of micro- and nano-fabricated devices to study complex biological processes has made it increasingly important to understand the effects of confinement on macromolecular behaviour. In this thesis, I will ... -
Theoretical Studies of Skewed Spin Ladders and Polycyclic Aromatic Hydrocarbons
This thesis is an effort to understand electronic structure and optical properties of low-dimensional conjugated molecules such as polyatomic aromatic hydrocarbons and nanoribbons composed of perylene monomers in addition ... -
Theoretical Studies of the Mechanisms of the Entry of Virus into Cells
(2018-02-09)Viruses cause human diseases by entering in to human cells. Many drugs have been developed that act at various stages of viral infection, but they fail due to their toxic side effects and high mutation rates of viruses. ... -
Theoretical Studies Of The Thermodynamics And Kinetics Of Selected Single-Molecule Systems
(2013-02-25)This thesis is a report of the work I have done over the last five years to study thermodynamic and kinetic aspects of single-molecule behavior in the condensed phase. It is concerned specifically with the development of ... -
Theoretical Studies on Excited-State Photodynamics: N-H Dissociation in Aniline and Intermolecular H atom Transfer in the 2-Amino Pyridine Dimer
DNA is composed of light-absorbing molecular units like adenine, guanine, thymine, cytosine, etc. It is well-known that DNA as a whole is photostable upon exposure to sunlight. The photostability of biomolecules suggests ... -
Theoretical Study Of Some Transport And Spectroscopic Phenomena In Two Materials Showing Large Magnetoresistance
(2009-07-09)In this thesis I present studies of some transport and spectroscopic properties for two di erent materials exhibiting large magnetoresistance. Both of these materials are oxides of transition metals, showing exotic magnetic ... -
A Theoretical Study of the Synergy and Lazy Annotation Algorithms
(2018-04-03)Given a program with assertions, the assertion checking problem is to tell whether there is an execution of the program that violates one of the assertions. One approach to this problem is to explore different paths towards ... -
A Theoretical Study of Thermoelectric Effect for Cross-plane Transport Across Twisted Bilayer Graphene
The thermoelectric effect and the linear response theory is one of the most studied areas in condensed matter physics. In the last few years, the study of Van Der Waals heterostructure has become one of the most promising ... -
Theory and Algorithms for sequential non-Gaussian Bayesian filtering and estimation
Seamless integration of dynamical system models with sparse measurements, called as Data Assimilation, is important in many applications like weather forecasting, socio-economics, navigation, and beyond. In order to produce ... -
Therapeutic Applications of Biodegradable Chitosan Based Polyelectrolyte Nanocapsules
(2018-01-18)The past few years have witnessed significant work being directed towards drug delivery systems with layer-by layer (LbL) technique prominently featured as one of the most sought after approach. However, majority of the ...