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Magnetic Dipole–dipole Interaction
Magnetic dipole–dipole interaction, also called dipolar coupling, refers to the direct interaction between two magnetic dipoles. Suppose and are two magnetic dipole moments that are far enough apart that they can be treated as point dipoles in calculating their interaction energy. The potential energy of the interaction is then given by: :: H = -\frac\left 3(\mathbf m_1\cdot\hat\mathbf r)(\mathbf m_2\cdot\hat\mathbf r) - \mathbf m_1\cdot\mathbf m_2\right\mu_0 \frac \mathbf m_1\cdot\mathbf m_2 \delta(\mathbf r) :: where is the magnetic constant, is a unit vector parallel to the line joining the centers of the two dipoles, and , , is the distance between the centers of and . Last term with \delta-function vanishes everywhere but the origin, and is necessary to ensure that \nabla\cdot\mathbf B vanishes everywhere. Alternatively, suppose and are gyromagnetic ratios of two particles with spin quanta and . (Each such quantum is some integral multiple of .) Then: :: H = - ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Magnetic Dipole
In electromagnetism, a magnetic dipole is the limit of either a closed loop of electric current or a pair of poles as the size of the source is reduced to zero while keeping the magnetic moment constant. It is a magnetic analogue of the electric dipole, but the analogy is not perfect. In particular, a true magnetic monopole, the magnetic analogue of an electric charge, has never been observed in nature. However, magnetic monopole quasiparticles have been observed as emergent properties of certain condensed matter systems. Moreover, one form of magnetic dipole moment is associated with a fundamental quantum property—the spin of elementary particles. Because magnetic monopoles do not exist, the magnetic field at a large distance from any static magnetic source looks like the field of a dipole with the same dipole moment. For higher-order sources (e.g. quadrupoles) with no dipole moment, their field decays towards zero with distance faster than a dipole field does. External m ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Protein Folding
Protein folding is the physical process by which a protein chain is translated to its native three-dimensional structure, typically a "folded" conformation by which the protein becomes biologically functional. Via an expeditious and reproducible process, a polypeptide folds into its characteristic three-dimensional structure from a random coil. Each protein exists first as an unfolded polypeptide or random coil after being translated from a sequence of mRNA to a linear chain of amino acids. At this stage the polypeptide lacks any stable (long-lasting) three-dimensional structure (the left hand side of the first figure). As the polypeptide chain is being synthesized by a ribosome, the linear chain begins to fold into its three-dimensional structure. Folding of many proteins begins even during translation of the polypeptide chain. Amino acids interact with each other to produce a well-defined three-dimensional structure, the folded protein (the right hand side of the figure ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Zero Field Splitting
Zero field splitting (ZFS) describes various interactions of the energy levels of a molecule or ion resulting from the presence of more than one unpaired electron. In quantum mechanics, an energy level is called degenerate if it corresponds to two or more different measurable states of a quantum system. In the presence of a magnetic field, the Zeeman effect is well known to split degenerate states. In quantum mechanics terminology, the degeneracy is said to be "lifted" by the presence of the magnetic field. In the presence of more than one unpaired electron, the electrons mutually interact to give rise to two or more energy states. Zero field splitting refers to this lifting of degeneracy even in the absence of a magnetic field. ZFS is responsible for many effects related to the magnetic properties of materials, as manifested in their electron spin resonance spectra and magnetism. The classic case for ZFS is the spin triplet, i.e., the S=1 spin system. In the presence of a magnet ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Magnetic Moment
In electromagnetism, the magnetic moment is the magnetic strength and orientation of a magnet or other object that produces a magnetic field. Examples of objects that have magnetic moments include loops of electric current (such as electromagnets), permanent magnets, elementary particles (such as electrons), various molecules, and many astronomical objects (such as many planets, some moons, stars, etc). More precisely, the term ''magnetic moment'' normally refers to a system's magnetic dipole moment, the component of the magnetic moment that can be represented by an equivalent magnetic dipole: a magnetic north and south pole separated by a very small distance. The magnetic dipole component is sufficient for small enough magnets or for large enough distances. Higher-order terms (such as the magnetic quadrupole moment) may be needed in addition to the dipole moment for extended objects. The magnetic dipole moment of an object is readily defined in terms of the torque that the ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Nuclear Overhauser Effect
The nuclear Overhauser effect (NOE) is the transfer of nuclear spin polarization from one population of spin-active nuclei (e.g. 1H, 13C, 15N etc.) to another via cross-relaxation. A phenomenological definition of the NOE in nuclear magnetic resonance spectroscopy (NMR) is the change in the integrated intensity (positive or negative) of one NMR resonance that occurs when another is saturated by irradiation with an RF field. The change in resonance intensity of a nucleus is a consequence of the nucleus being close in space to those directly affected by the RF perturbation. The NOE is particularly important in the assignment of NMR resonances, and the elucidation and confirmation of the structures or configurations of organic and biological molecules. The 1H two-dimensional NOE SpectroscopY (NOESY) experiment and its extensions are important tools to identify stereochemistry of proteins and other biomolecules in solution, whereas in solid form crystal x-ray diffraction typicall ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Residual Dipolar Coupling
The residual dipolar coupling between two spins in a molecule occurs if the molecules in solution exhibit a partial alignment leading to an incomplete averaging of spatially anisotropic dipolar couplings. Partial molecular alignment leads to an incomplete averaging of anisotropic magnetic interactions such as the magnetic dipole-dipole interaction (also called dipolar coupling), the chemical shift anisotropy, or the electric quadrupole interaction. The resulting so-called ''residual'' anisotropic magnetic interactions are becoming increasingly important in biomolecular NMR spectroscopy. History and pioneering works NMR spectroscopy in partially oriented media was first discovered in 1963, and in a very fundamental paper Alfred Saupe was also able to present the essential theory to describe and understand the observable phenomena only one year later. After this initiation a flood of NMR spectra in various liquid crystalline phases was reported (see ''e.g.'' ). A second techni ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Magic Angle
The magic angle is a precisely defined angle, the value of which is approximately 54.7356°. The magic angle is a root of a second-order Legendre polynomial, , and so any interaction which depends on this second-order Legendre polynomial vanishes at the magic angle. This property makes the magic angle of particular importance in magic angle spinning solid-state NMR spectroscopy. In magnetic resonance imaging, structures with ordered collagen, such as tendons and ligaments, oriented at the magic angle may appear hyperintense in some sequences; this is called the magic angle artifact or effect. Mathematical definition The magic angle ''θ''m is : \theta_\mathrm = \arccos \frac = \arctan \sqrt \approx 0.955\,32\ \text \approx 54.7^\circ \! , where arccos and arctan are the inverse cosine and tangent functions respectively. ''θ''m is the angle between the space diagonal of a cube and any of its three connecting edges, see image. Another representation of the magic angle is half o ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
J-coupling
In nuclear chemistry and nuclear physics, ''J''-couplings (also called spin-spin coupling or indirect dipole–dipole coupling) are mediated through chemical bonds connecting two spins. It is an indirect interaction between two nuclear spins that arises from hyperfine interactions between the nuclei and local electrons. In NMR spectroscopy, ''J''-coupling contains information about relative bond distances and angles. Most importantly, ''J''-coupling provides information on the connectivity of chemical bonds. It is responsible for the often complex splitting of resonance lines in the NMR spectra of fairly simple molecules. ''J''-coupling is a frequency ''difference'' that is not affected by the strength of the magnetic field, so is always stated in Hz. Vector model and manifestations for chemical structure assignments The origin of ''J''-coupling can be visualized by a vector model for a simple molecule such as hydrogen fluoride (HF). In HF, the two nuclei have spin . Four states ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Residual Dipolar Coupling
The residual dipolar coupling between two spins in a molecule occurs if the molecules in solution exhibit a partial alignment leading to an incomplete averaging of spatially anisotropic dipolar couplings. Partial molecular alignment leads to an incomplete averaging of anisotropic magnetic interactions such as the magnetic dipole-dipole interaction (also called dipolar coupling), the chemical shift anisotropy, or the electric quadrupole interaction. The resulting so-called ''residual'' anisotropic magnetic interactions are becoming increasingly important in biomolecular NMR spectroscopy. History and pioneering works NMR spectroscopy in partially oriented media was first discovered in 1963, and in a very fundamental paper Alfred Saupe was also able to present the essential theory to describe and understand the observable phenomena only one year later. After this initiation a flood of NMR spectra in various liquid crystalline phases was reported (see ''e.g.'' ). A second techni ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Potential Energy
In physics, potential energy is the energy held by an object because of its position relative to other objects, stresses within itself, its electric charge, or other factors. Common types of potential energy include the gravitational potential energy of an object, the elastic potential energy of an extended spring, and the electric potential energy of an electric charge in an electric field. The unit for energy in the International System of Units (SI) is the joule, which has the symbol J. The term ''potential energy'' was introduced by the 19th-century Scottish engineer and physicist William Rankine, although it has links to Greek philosopher Aristotle's concept of potentiality. Potential energy is associated with forces that act on a body in a way that the total work done by these forces on the body depends only on the initial and final positions of the body in space. These forces, that are called ''conservative forces'', can be represented at every point in space by ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Nuclear Overhauser Effect
The nuclear Overhauser effect (NOE) is the transfer of nuclear spin polarization from one population of spin-active nuclei (e.g. 1H, 13C, 15N etc.) to another via cross-relaxation. A phenomenological definition of the NOE in nuclear magnetic resonance spectroscopy (NMR) is the change in the integrated intensity (positive or negative) of one NMR resonance that occurs when another is saturated by irradiation with an RF field. The change in resonance intensity of a nucleus is a consequence of the nucleus being close in space to those directly affected by the RF perturbation. The NOE is particularly important in the assignment of NMR resonances, and the elucidation and confirmation of the structures or configurations of organic and biological molecules. The 1H two-dimensional NOE SpectroscopY (NOESY) experiment and its extensions are important tools to identify stereochemistry of proteins and other biomolecules in solution, whereas in solid form crystal x-ray diffraction typicall ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Pake Doublet
A Pake Doublet (or "Pake Pattern") is a characteristic line shape seen in solid-state nuclear magnetic resonance and electron paramagnetic resonance spectroscopy. It was first described by George Pake. It arises from dipolar coupling between isolated two spin-1/2 nuclei, or from transitions in quadrupolar nuclei such as deuterium. It is the general shape obtained from an orientationally dependent doublet. The "horns" of the Pake doublet correspond to the situation when the principal axis of the coupling interaction (the internuclear vector in the case dipolar coupling and the principal component of the electric field gradient tensor for quadrupolar nuclei) is perpendicular to the magnetic field. This situation is the most probable and the intensity is much higher. The "feet" of the lineshape correspond to the situation when the principal axis of the coupling interaction is parallel to the magnetic field which is much less statistically relevant. Pake was the first to describe ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
