Force field

Results: 1342



#Item
301Theoretical chemistry / Basis set / Hartree–Fock method / Tight binding / Atomic orbital / Molecular orbital / Molecular dynamics / Conjugated system / Force field / Chemistry / Quantum chemistry / Computational chemistry

THE JOURNAL OF CHEMICAL PHYSICS 128, 234108 共2008兲 The variational explicit polarization potential and analytical first derivative of energy: Towards a next generation force field Wangshen Xie, Lingchun Song, Donald

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:06
302Intermolecular forces / Metalloproteins / Chemical bonding / Molecular dynamics / Force field / QM/MM / Hydrogen bond / Root-mean-square deviation / Zinc / Chemistry / Computational chemistry / Molecular modelling

Submitted to The Journal of Physical Chemistry Determination of the Structure Form of the Fourth Ligand of Zinc in Acutolysin A using Combined Quantum Mechanical and Molecular Mechanical Simulation

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:07
303Molecular modelling / Austin Model 1 / Molecular dynamics / Force field / Fragment molecular orbital / QM/MM / Hartree–Fock method / Mulliken population analysis / NDDO / Chemistry / Computational chemistry / Quantum chemistry

ohio2/yjp-yjp/yjp-yjp/yjp99907/yjp5958d07z xppws 23:ver[removed]:10 Msc: jp-2008-04512f TEID: kbg00 BATID: jp10c111 J. Phys. Chem. B XXXX, xxx, [removed]

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Source URL: www.dtc.umn.edu

Language: English - Date: 2012-08-16 12:29:06
304Field service management / Management / Dispatch / Project management software / GPS / Tracking / Transport / Logistics / Technology

Dispatch The Nexterna™ Clearview Dispatch module provides companies with the tools to effectively manage their service force. Dispatchers have a complete view of all service activity and technician availability, allowi

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Source URL: www.nexterna.com

Language: English - Date: 2010-04-26 08:53:37
305Aleutian World War II National Historic Area / Attu Island / Aleutian Islands / Kiska Harbor / Kiska / Adak Island / Dutch Harbor Naval Operating Base and Fort Mears /  U.S. Army / Cape Field at Fort Glenn / Eleventh Air Force / Alaska / Aleutian Islands Campaign / Japanese Occupation Site /  Kiska Island

World War II Resource Guide.indd

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Source URL: www.explorenorth.com

Language: English - Date: 2008-12-07 12:03:58
306Scientific method / Analgesics / Raman spectroscopy / Intermolecular forces / Microscopy / Near-field scanning optical microscope / Spectroscopy / Atomic force microscopy / Raman scattering / Scanning probe microscopy / Chemistry / Science

NTEGRA Spectra: Pharmaceutical Application AFM-Raman Characterization of Pharmaceutical Tablets Compound Distribution Studies in Pharmaceutical Tablets by Integrated AFM-Raman Instrument

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Source URL: www.ntmdt.com

Language: English - Date: 2012-07-13 03:01:34
307Protein structure / Molecular modelling / Force field / X-ray crystallography / Adaptive mesh refinement / Chemistry / Science / Crystallography

The Phenix refinement framework Afonine#, P.V., Grosse-Kunstleve, R.W. & Adams, P.D.

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Source URL: www.ccp4.ac.uk

Language: English - Date: 2005-07-27 10:41:38
308Scientific method / Analgesics / Raman spectroscopy / Intermolecular forces / Microscopy / Near-field scanning optical microscope / Spectroscopy / Atomic force microscopy / Raman scattering / Scanning probe microscopy / Chemistry / Science

NTEGRA Spectra: Pharmaceutical Application AFM-Raman Characterization of Pharmaceutical Tablets Compound Distribution Studies in Pharmaceutical Tablets by Integrated AFM-Raman Instrument

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Source URL: ntmdt.com

Language: English - Date: 2012-07-13 03:01:34
309Scientific method / Near-field scanning optical microscope / Raman spectroscopy / Graphene / Atomic force microscopy / Microscopy / Microscope / Magnetic force microscope / Piezoresponse force microscopy / Scanning probe microscopy / Chemistry / Science

Graphene Comprehensive AFM / Optical / Raman / TERS* Characterization in the Single Experiment White light image of the graphene flake with AFM tip and Raman laser spot

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Source URL: www.ntmdt.com

Language: English - Date: 2012-07-13 02:55:13
310Magnetostatics / Physical quantities / Scanning probe microscopy / Magnetic force microscope / Magnetic moment / Magnetic field / Dipole / Magnet / Permeability / Electromagnetism / Physics / Magnetism

hh tt tt pp :: // // ww ww ww .. nn tt m m dd tt .. cc oo m m Magnetic Force Microscopy: Quantitative Results Treatment[removed]MFM general concept

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Source URL: www.ntmdt.com

Language: English - Date: 2008-01-29 12:03:08
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