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Page "Computational chemistry" ¶ 48
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Molecular and dynamics
** Molecular dynamics, the study of motion on the molecular level
** Molecular dynamics
; Molecular dynamics: Application of classical mechanics for simulating the movement of the nuclei of an assembly of atoms and molecules.
* Molecular dynamics
Molecular physics is the study of the physical properties of molecules, the chemical bonds between atoms as well as the molecular dynamics.
Molecular Dynamics ( MD ) is an important tool for studying protein folding and dynamics in silico.
* Ascalaph Molecular dynamics with fourth order symplectic integrator.
* Molecular dynamics
* LAMMPS ( Large-scale Atomic / Molecular Massively Parallel Simulator ) is a molecular dynamics library that can be used to model parallel atomic / subatomic processes at large scale.
* Molecular dynamics
Molecular dynamics ( MD ) is a computer simulation of physical movements of atoms and molecules.
Molecular dynamics is used in many fields of science.
Molecular dynamics simulations were used to probe the mechanisms of viral assembly.
* Molecular dynamics simulation methods revised
* Molecular dynamics, a form of computer simulation where atoms and molecules are allowed to interact for a period of time under known laws of physics
Category: Molecular dynamics software
NAMD ( Not ( just ) Another Molecular Dynamics program ) is a free-of-charge molecular dynamics simulation package written using the Charm ++ parallel programming model, noted for its parallel efficiency and often used to simulate large systems ( millions of atoms ).
Category: Molecular dynamics software
Category: Molecular dynamics software
Category: Molecular dynamics software
Category: Molecular dynamics software
Molecular mechanics or molecular dynamics are most often used to predict the conformation of the small molecule and to model conformational changes in the biological target that may occur when the small molecule binds to it.
Molecular physics is the study of the physical properties of molecules, the chemical bonds between atoms as well as the molecular dynamics.
* Molecular dynamics

Molecular and MD
Docking @ Home, hosted by University of Delaware, one of the projects which use an opensource platform for the distributed computing, BOINC, adopts CHARMM to analyze the atomic details of protein-ligand interactions in terms of Molecular Dynamics ( MD ) simulations and minimizations.

Molecular and use
Molecular mechanics simulations, for example, use a single classical expression for the energy of a compound, for instance the harmonic oscillator.
A notable use of the term can be found in the Central Dogma of Molecular Biology.
The European Molecular Biology Laboratory EMBL made use of the possibilities that arose with the new technology and in 1972 established a permanent branch at DESY with the aim of analyzing the structure of biological molecules by means of synchrotron radiation.
Molecular biologists use several shorthand terms when referring to nucleic acid molecules, such as DNA and RNA, collectively referred to as nucleic acid nomenclature.
Molecular phylogenetics is one aspect of molecular systematics, a broader term that also includes the use of molecular data in taxonomy and biogeography.
* Molecular gastronomy, the applied use of chemical and physical processes in the preparation of food
In 1994, his paper Molecular Computation of Solutions To Combinatorial Problems described the experimental use of DNA as a computational system.
Because of him, orders are sent to the Fleet to prevent the use of the Molecular Disruption Device.
The Quantized Valence Bonds ' Molecular Mechanics ( QVBMM ) force field ( implemented in Exorga, Incorporated's StruMM3D product, once named STR3DI32 ) is unique in molecular mechanics as the only one to directly use all lone pair interactions in all of its energy calculations.
In 2004, the Laboratory for Molecular Systematics and Ecology ( LMSE ) was formed as a shared, multi-user facility to improve access to and provide training for the use of molecular data in systematic and ecological research.
Molecular mechanics is one aspect of molecular modelling, as it refers to the use of classical mechanics / Newtonian mechanics to describe the physical basis behind the models.
In 1956, Dicke filed a patent titled " Molecular Amplification Generation Systems and Methods " with claims of how to build an infrared laser and the use of an open resonator.
The college is currently constructing the Center for Molecular and Life Sciences, a new $ 30 million, laboratory facility, which is expected to be ready for use in 2012.
Molecular memory is a term for data storage technologies that use molecular species as the data storage element, rather than e. g. circuits, magnetics, inorganic materials or physical shapes.
Molecular gastronomy is a subdiscipline of food science that seeks to investigate, explain and make practical use of the physical and chemical transformations of ingredients that occur while cooking, as well as the social, artistic and technical components of culinary and gastronomic phenomena in general.

Molecular and either
Molecular nanowires are composed of repeating molecular units either organic ( e. g. DNA ) or inorganic ( e. g. Mo < sub > 6 </ sub > S < sub > 9-x </ sub > I < sub > x </ sub >).
Molecular systematics has been made possible by the availability of techniques for DNA sequencing, which allow the determination of the exact sequence of nucleotides or bases in either DNA or RNA.
He'd also seen that the absorption behavior of molecules is quite different from that of the atoms composing the molecules — for example the gas nitric oxide ( NO ) absorbed more than a thousand times more infrared radiation than either nitrogen ( N < sub > 2 </ sub >) or oxygen ( O < sub > 2 </ sub >).< ref > Contributions to Molecular Physics in the Domain of Radiant Heat, pp. 80 – 81.
* Provide access for UK researchers to large research facilities, which it achieves either by owning them and operating them or through international subscriptions to major facilities such as the European Organisation for Nuclear Research ( CERN ) and the European Molecular Biology Laboratory.
Molecular phylogenetic evidence demonstrates that asexual Neotyphodium species are derived either from individual Epichloë species, or more commonly, from hybrids with at least two ancestral Epichloë species.
Molecular motors, when signaled, will either carry melanosomes containing pigments out to the periphery of the cell, or concentrate them at the center.
Molecular phylogenetic studies show that, as an ancient species in the order Carnivora, the Red Panda is relatively close to the American Raccoon and may be either a monotypic family or a subfamily within the procynonid family.
* The Molecular Biotechnology Diploma differs from other Biotechnology Diploma courses with its newer and revised approach that does not include the more classical modules such as Plant cell technology offered by other Biotechnology courses, while offering modules such as Proteomics and Drug Development which are either absent in most other Biotechnology courses, or are only available as elective modules.
Molecular studies suggest that Acanthocheilonema viteae either lost their symbionts before they became essential or diverged from other filaroids before Wolbachia acquisition ( Schmidt and Roberts, 2009 ).

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