Computational chemistry

Results: 1931



#Item
591Crystallography / Application software / CCP4 / Research Councils / Science and technology in the United Kingdom / MRC / Coot / Biotechnology and Biological Sciences Research Council / Science / Computational chemistry / Chemistry

Chair’s  report  to  WG1,  January  4th  2014.   1 Progress  in  respect  of  resolutions  from  the  last  WG1   meeting   1.1 Discussion  and  vote:  Thanks

Add to Reading List

Source URL: www.ccp4.ac.uk

Language: English - Date: 2014-01-16 09:43:07
592MRC / Molecular replacement / Computational chemistry / Crystallography / CCP4

MINUTES OF THE WORKING GROUP 1 MEETING OF CCP4HELD AT YORK ON JANUARY 7, 2000

Add to Reading List

Source URL: www.ccp4.ac.uk

Language: English - Date: 2008-05-02 11:04:41
593Energy / Science / Computational chemistry / Chemical bonding / Embedded atom model

Nuclear Instruments and Methods in Physics Research B–125 www.elsevier.com/locate/nimb Relation between thermal expansion and interstitial formation energy in pure Fe and Cr Janne Wallenius

Add to Reading List

Source URL: www.neutron.kth.se

Language: English
594Cheminformatics / Computational chemistry / Medicinal chemistry / Pharmacology / Quantitative structure–activity relationship / Regression model validation / Validation / Statistics / Science / Chemistry

5.10 Additional File 10: Information included in OpenTox Reports Information that should be included in most OpenTox reports is as follows:_¶_ General information Date Runtime User (if available)

Add to Reading List

Source URL: jcheminf.com

Language: English
595Statistics / Mac OS X / Computational chemistry / Multivariate statistics / Spectroscopy / The Unscrambler / Installation / Multivariate analysis / Mac OS X Panther / System software / Software / Installation software

Unscrambler® X Classification Engine Installation Manual Version 10.3 CAMO SOFTWARE AS Nedre Vollgate 8, N-0158, Oslo, NORWAY

Add to Reading List

Source URL: www.camo.com

Language: English - Date: 2013-07-05 08:51:55
596Sports / CAMO / Microsoft / SAP AG / Computing / Software industry / Computational chemistry / Spectroscopy / The Unscrambler

Newsletter to CAMO AS shareholders Q1 2011 Share price = NOK 0.30 per share st CAMO AS and CAMO Software AS were merged as per 1 of January 2011, and are now trading as ‘CAMO Software AS’. The holding company, CAMO S

Add to Reading List

Source URL: www.camo.com

Language: English - Date: 2011-05-25 01:30:00
597Actinides / Nuclear chemistry / Nuclear reprocessing / Energy conversion / Boiling water reactor / Computational fluid dynamics / Nuclear fuel / Light water reactor / Nuclear reactor / Nuclear physics / Energy / Nuclear technology

NURESIM A world-class multiphysics-multiscale software set for light water nuclear reactor simulation The NURESIM Platform

Add to Reading List

Source URL: www.nuresafe.eu

Language: English - Date: 2014-11-10 08:26:55
598NAMD / Visual Molecular Dynamics / Computational chemistry / Molecular modelling / Molecular dynamics / TCB / Computer science / Visualization / Software developer / Science / Application software / Computing

TCBG Clockwise from left: Laxmikant Kalé, Zan Luthey-Schulten, Emad Tajkhorshid, Aleksei Aksimentiev, Klaus Schulten The TCB group includes five U of I faculty – computer science

Add to Reading List

Source URL: www.ks.uiuc.edu

Language: English - Date: 2005-10-17 14:21:13
599Colloidal chemistry / Scattering / Visibility / Computational science / Electromagnetic radiation / Mie scattering / Transparency and translucency / Atmospheric radiative transfer codes / Refractive index / Physics / Atmospheric sciences / Science

Atmos. Meas. Tech., 8, 1913–1933, 2015 www.atmos-meas-tech.netdoi:amt © Author(sCC Attribution 3.0 License. On the microwave optical properties of randomly

Add to Reading List

Source URL: www.atmos-meas-tech.net

Language: English - Date: 2015-05-05 02:44:04
600Computational chemistry / Thermodynamics / Molecular modelling / Molecular dynamics / Debye–Hückel theory / Poisson–Boltzmann equation / Implicit solvation / Ionic strength / Activity / Chemistry / Science / Colloidal chemistry

Mereghetti et al. BMC Biophysics 2014, 7:4 http://www.biomedcentral.comRESEARCH ARTICLE Open Access

Add to Reading List

Source URL: www.biomedcentral.com

Language: English
UPDATE