molecular-modeling program

molecular-modeling program
программа моделирования молекул; программа молекулярного моделирования

Англо-русский словарь по вычислительной технике и информационным технологиям - 4-е изд.. .

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  • Molecular modeling on GPU — Ionic liquid simulation on GPU (Ascalaph Designer) Molecular modeling on GPU is the technique of using a graphics processing unit (GPU) for molecular simulations. [1] In 2007, NVIDIA introduced video cards that could be used not only to show… …   Wikipedia

  • Molecular design software — is software for molecular modeling, that provides special support for developing molecular models de novo. In contrast to the usual molecular modeling programs such as the molecular dynamics and quantum chemistry programs, such software directly… …   Wikipedia

  • Molecular dynamics — (MD) is a computer simulation of physical movements of atoms and molecules. The atoms and molecules are allowed to interact for a period of time, giving a view of the motion of the atoms. In the most common version, the trajectories of molecules… …   Wikipedia

  • Molecular mechanics — A force field is used to minimize the bond stretching energy of this ethane molecule. Molecular mechanics uses Newtonian mechanics to model molecular systems. The potential energy of all systems in molecular mechanics is calculated using force… …   Wikipedia

  • Molecular modelling — The backbone dihedral angles are included in the molecular model of a protein. Modelling of ionic li …   Wikipedia

  • Molecular graphics — (MG) is the discipline and philosophy of studying molecules and their properties through graphical representation.[1] IUPAC limits the definition to representations on a graphical display device .[2] Ever since Dalton s atoms and Kekulé s benzene …   Wikipedia

  • Molecular assembler — Part of a series of articles on Molecular Nanotechnology …   Wikipedia

  • Software tools for molecular microscopy — There are a large number of software tools or software applications that have been specifically developed for the field sometimes referred to as molecular microscopy or cryo electron microscopy or cryoEM. Several special issues of the Journal of… …   Wikipedia

  • Docking (molecular) — Docking glossary • Receptor or host or lock – The receiving molecule, most commonly a protein or other biopolymer. • Ligand or guest or key – The complementary partner molecule which binds to the receptor. Ligands are most often small molecules… …   Wikipedia

  • Cobalt (CAD program) — Cobalt’s integral ray tracing capabilities afford the designer detailed control of a wide variety of surface properties, including the amount of dimpling in the polished sandstone table. Shown here is a high end espresso tamper with an integral… …   Wikipedia

  • Orac (MD program) — This article is about a molecular dynamics program. For more meanings of the word Orac, see ORAC. Orac is a classical molecular dynamics computer program (written in FORTRAN language) for simulating complex molecular systems at the atomistic… …   Wikipedia


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