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Computational Chemistry Journals (Popularity: )
(Score: 13.19)
http://www.ch.cam.ac.uk/c2k/cj/comp.html
A comprehensive list of journals known to publish articles about computational chemistry, even when the main focus of the journal is not computational chemistry.
Category: Science\Chemistry\Computational\Journals
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Computational Chemistry Group, U.S. National Institute of Standards and Technology (NIST) (Popularity: )
(Score: 12.06)
http://www.nist.gov/compchem/
Ab initio quantum chemistry and computational thermochemistry.
Category: Science\Chemistry\Computational\Research Groups
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Computational Chemistry Jobs (Popularity: )
(Score: 11.99)
http://www.ccl.net/chemistry/announcements/jobs/index.shtml
A free job listing service for computational chemistry professionals and employers. Also an area for positions wanted and for upcoming conferences.
Category: Science\Chemistry\Employment
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Computational Chemistry List (Popularity: )
(Score: 11.97)
http://www.ccl.net/chemistry/
A resource for computational chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular mechanics, molecular dynamics, QSAR, molecular graphics, molecular modeling, and associated archives
Category: Science\Chemistry\Computational
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Extensible Computational Chemistry Environment (Popularity: )
(Score: 11.70)
http://ecce.emsl.pnl.gov/
Graphical user interface for Linux/Solaris/IRIX with visualization tools and a data management framework for setting up, submitting, and analyzing computational chemistry calculations.
Category: Science\Chemistry\Software\Physical and Theoretical
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National Institute of Standards and Technology Computational Chemistry Group (Popularity: )
(Score: 10.97)
http://www.nist.gov/compchem/
Group involved in the development of databases and systematic testing, evaluation and benchmarking of quantum chemistry methods to establish the accuracy, reliability, applicability and relative merits of different computational tools ...
Category: Science\Chemistry\Physical\Academia and Institutes
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NWChem High Performance Computational Chemistry Software (Popularity: )
(Score: 10.95)
http://www.emsl.pnl.gov/docs/nwchem/nwchem.html
NWChem is a computational chemistry software capable of molecular dynamics simulations. It is designed to run on parallel computers and it is developed by the Pacific Northwest National Laboratory.
Category: Science\Chemistry\Computational\Molecular Dynamics
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Inorganic Nanotubes (Popularity: )
(Score: 10.74)
http://nanotech.about.com/science/nanotech/library/weekly/aa082000a.htm
About.com - The arrangement of atoms into cylindrical nanocrystals is a stable phase for numerous elements. The inert nature of boron nitride and tungsten disulfide nanotubes makes them particularly durable ...
Category: Science\Technology\Nanotechnology\Articles
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Bologna Electrochemistry Group (Popularity: )
(Score: 10.21)
http://www.ciam.unibo.it/electrochem/
Large variety of experimental and computational techniques are applied to Metal complexes, Mechanically-interlocked systems, Fullerene and Carbon Nanotubes, Biosensors and Biologically-active systems.
Category: Science\Chemistry\Electrochemistry\Research Groups
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Theoretical Chemistry Accounts (Popularity: )
(Score: 10.20)
http://springerlink.metapress.com/app/home/journal.asp?wasp=e2ggvmvwlp12076klqfw&referrer=parent&backto=linkingpublicationresults,1:100493,1
Publishes papers in all fields of theoretical chemistry, computational chemistry, and modeling.
Category: Science\Chemistry\Publications\Journals
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WWW Chemistry Guide (Popularity: )
(Score: 9.95)
http://www.chemistryguide.org
WWW Chemistry Guide - a collection of links for chemists and researchers involved in organic, biochemical, computational, medicinal and/or other chemistry research.
Category: Science\Chemistry\Directories
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Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta) (Popularity: )
(Score: 9.95)
http://link.springer.de/link/service/journals/00214/
Publishes papers in all fields of theoretical chemistry, computational chemistry, and modeling.
Category: Science\Chemistry\Computational\Journals
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Computational Chemistry and Organic Synthesis (Popularity: )
(Score: 9.72)
http://www.cmbi.ru.nl/tutorials/cheminf/mopac/comp.html
A tutorial intended for experimental organic chemists, with emphasis on computational methods for locating and characterizing transition states.
Category: Science\Chemistry\Computational
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Nanotubes gain larger kin (Popularity: )
(Score: 9.64)
http://www.trnmag.com/Stories/101800/Graphite_Polyhedrals_101800.htm
Technology Research News - ory. Researchers at Drexel University have discovered giant nanotubes in the pores of glassy carbon, an industrial material. These graphite polyhedral crystals range up to several ...
Category: Science\Technology\Nanotechnology\Articles
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Computational Chemistry List - Software (Popularity: )
(Score: 9.38)
http://www.ccl.net/cca/software/
Archive of chemistry software for Unix, MS-DOS, Windows, Mac. Includes source code in most cases.
Category: Science\Chemistry\Software\Directories
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The Chemistry Development Kit (Popularity: )
(Score: 9.35)
http://cdk.sourceforge.net/
Java based computational chemistry package which supports chemical structure drawing and the graphical layout of 2D chemical structures.
Category: Science\Chemistry\Software\Development
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Journal of Theoretical and Computational Chemistry (JTCC) (Popularity: )
(Score: 9.04)
http://www.worldscinet.com/jtcc/jtcc.shtml
Covers the development of fundamental theoretical methodology and computational algorithms to extensive numerical applications to specific scientific problems ranging from gas-phase to condensed phase, and to biological systems.
Category: Science\Chemistry\Computational\Journals
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Medicinal Chemistry Links (Popularity: )
(Score: 8.94)
http://www.phc.vcu.edu/othercoolsites.html
A collection of links for chemists and students involved in organic, biochemical, computational, and/or medicinal chemistry research, maintained by Virginia Commonwealth University.
Category: Science\Chemistry\Directories
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Asian Journal Of Biochemical And Pharmaceutical Research (Popularity: )
(Score: 8.93)
http://www.ajbpr.com
It's a peer-reviewed multi-disciplinary journal in chemistry, biotechnology and pharmaceutical field, scheduled to appear quarterly and to serve as a means for exchanging scientific information in international chemistry, biotechnology and ...
Category: Science\Medical Science\Journals
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Singlewalled Carbon Nanotubes (Popularity: )
(Score: 8.80)
http://reinste.com/Carbon_Nano_tubes_singlewalled.html
Reinste has launched finest research and industrial grade singlewall (SWCNTs) and multiwall carbon nanotubes (MWCNTs) with more than 99% purity. The name “Reinste” (pronounced as – “ra-in-stay”) is coined after ...
Category: Science\Technology\Nanotechnology
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