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Computational Chemistry Journals (Popularity:  )
(Score: 20.38)
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:
Main\Science\Chemistry\Computational\Journals
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Computational Chemistry Group, U.S. National Institute of Standards and Technology (NIST) (Popularity: )
(Score: 18.63)
http://www.nist.gov/compchem/
Ab initio quantum chemistry and computational thermochemistry.
Category:
Main\Science\Chemistry\Computational\Research Groups
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Computational Chemistry Jobs (Popularity: )
(Score: 18.57)
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:
Main\Science\Chemistry\Employment
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Computational Chemistry List (Popularity: )
(Score: 18.54)
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:
Main\Science\Chemistry\Computational
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Extensible Computational Chemistry Environment (Popularity: )
(Score: 18.07)
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:
Main\Science\Chemistry\Software\Physical and Theoretical
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Division of Chemistry and Chemical Engineering (Popularity: )
(Score: 17.14)
http://www.caltech.edu/subpages/chem.html
Research areas include biochemistry, physical chemistry, advanced spectroscopy, and computational chemistry.
Category:
Main\Reference\Education\Colleges and Universities\North America
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NWChem High Performance Computational Chemistry Software (Popularity: )
(Score: 16.96)
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:
Main\Science\Chemistry\Computational\Molecular Dynamics
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National Institute of Standards and Technology Computational Chemistry Group (Popularity: )
(Score: 16.94)
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 and approaches for ...
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Main\Science\Chemistry\Physical\Academia and Institutes
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Department of Chemistry (Popularity: )
(Score: 16.06)
http://www.chem.psu.edu/
Programs in the core areas of chemistry: organic, inorganic, analytical, biological, and physical and graduate research in the interdisciplinary areas of: life sciences; materials; polymers; surface chemistry; computational chemistry and nanofabrication ...
Category:
Main\Reference\Education\Colleges and Universities\North America
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Theoretical Chemistry Accounts (Popularity: )
(Score: 15.93)
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:
Main\Science\Chemistry\Publications\Journals
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Alchemist's Corner (Popularity: )
(Score: 15.58)
http://www.geocities.com/alchemistrial/
Covers computational chemistry and some history of chemistry.
Category:
Main\Science\Chemistry\History
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Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta) (Popularity: )
(Score: 15.55)
http://link.springer.de/link/service/journals/00214/
Publishes papers in all fields of theoretical chemistry, computational chemistry, and modeling.
Category:
Main\Science\Chemistry\Computational\Journals
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Cerep (Popularity: )
(Score: 15.25)
http://www.cerep.fr/
Provides services in pharmacology, in molecular biology and lead development, in toxicology, metabolism and bio-availability, in combinatorial chemistry, HTS, HTP, HTLD and computational chemistry.
Category:
Main\Business\Biotechnology and Pharmaceuticals\Pharmaceuticals\Outsourcing
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Cerep (Popularity: )
(Score: 15.25)
http://www.cerep.fr/
Provides services in pharmacology, in molecular biology and lead development, in toxicology, metabolism and bio-availability, in combinatorial chemistry, HTS, HTP, HTLD and computational chemistry.
Category:
Main\Business\Biotechnology and Pharmaceuticals\Pharmaceuticals\Research and Development
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Computational Chemistry and Organic Synthesis (Popularity: )
(Score: 14.89)
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:
Main\Science\Chemistry\Computational
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Computational Chemistry List - Software (Popularity: )
(Score: 14.65)
http://www.ccl.net/cca/software/
Archive of chemistry software for Unix, MS-DOS, Windows, Mac. Includes source code in most cases.
Category:
Main\Science\Chemistry\Software\Directories
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The Chemistry Development Kit (Popularity: )
(Score: 14.61)
http://cdk.sourceforge.net/
Java based computational chemistry package which supports chemical structure drawing and the graphical layout of 2D chemical structures.
Category:
Main\Science\Chemistry\Software\Development
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Journal of Theoretical and Computational Chemistry (JTCC) (Popularity: )
(Score: 13.93)
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:
Main\Science\Chemistry\Computational\Journals
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Medicinal Chemistry Links (Popularity: )
(Score: 13.92)
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:
Main\Science\Chemistry\Directories
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Chemical & Pharmaceutical Bulletin (Popularity: )
(Score: 13.63)
http://cpb.pharm.or.jp/
Covers physical and inorganic chemistry, organic chemistry including natural products chemistry, medicinal chemistry, analytical chemistry, pharmacognosy and physical chemistry.
Category:
Main\Science\Chemistry\Organic\Journals
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Erik's Chemistry (Popularity: )
(Score: 13.38)
http://eppe.tripod.com/
A student made page with information about general chemistry, AP chemistry, organic chemistry and physical chemistry.
Category:
Main\Science\Chemistry\Education
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Schlegel Group (Popularity: )
(Score: 13.34)
http://chem.wayne.edu/schlegel/
Computational chemistry.
Category:
Main\Science\Chemistry\Computational\Research Groups
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Organic & Biomolecular Chemistry (Popularity: )
(Score: 13.23)
http://www.rsc.org/is/journals/current/obc/obcpub.htm
Brings together molecular design, synthesis, structure, function and reactivity in one journal. It publishes fundamental work on synthetic, physical and biomolecular organic chemistry as well as all organic aspects of: chemical biology, medicinal chemistry ...
Category:
Main\Science\Chemistry\Organic\Journals
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Baik Group (Popularity: )
(Score: 13.05)
http://mypage.iu.edu/~mbaik/home.htm
Computational chemistry and molecular modeling.
Category:
Main\Science\Chemistry\Computational\Research Groups
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First Principles Research (Popularity: )
(Score: 12.78)
http://www.firstprinciples.com/
Ab initio quantum chemistry and computational studies of superconductors.
Category:
Main\Science\Chemistry\Computational\Research Groups
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Systematichem (Popularity: )
(Score: 12.78)
http://www.syschem.com
Computational organic chemistry software for retrosynthesis and synthesis development.
Category:
Main\Science\Chemistry\Organic\Software
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Collaborative Computational Projects (Popularity: )
(Score: 12.65)
http://www.ccp.ac.uk/
Links to chemistry, physics, and engineering codes, many in Fortran.
Category:
Main\Computers\Programming\Languages\Fortran
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Canadian Journal of Chemistry (Popularity: )
(Score: 12.58)
http://www.nrc.ca/cgi-bin/cisti/journals/rp/rp2_desc_e?cjc
Publishes outstanding research articles and comprehensive reviews by international contributors in analytical, inorganic, organic, and physical-theoretical chemistry. Articles on electrochemistry, surface chemistry, theoretical chemistry, bio-synthesis ...
Category:
Main\Science\Chemistry\Publications\Journals
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Karuso Group (Popularity: )
(Score: 12.52)
http://www.chem.mq.edu.au/~vislab/index.html
Organic synthesis, NMR spectroscopy, computational chemistry, ecology, microbiology and biochemistry.
Category:
Main\Science\Chemistry\Organic\Research Groups
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Organic Chemistry Help (Popularity: )
(Score: 12.48)
http://www.chemhelper.com/
Find organic chemistry tutorials, chemistry FAQs, self-grading tests, common organic chemistry reaction mechanisms, and indexed chemistry links.
Category:
Main\Science\Chemistry\Education
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Computational Biology and Chemistry (Popularity: )
(Score: 12.46)
http://www.sciencedirect.com/science/journal/14769271
Publishes original papers and reviews in all areas of computational life sciences, such as nucleic acid and protein sequence research, molecular evolution, molecular genetics (functional genomics and proteomics), theory and practice of either biologyspecific ...
Category:
Main\Science\Chemistry\Computational\Journals
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ZAAC - Zeitschrift für anorganische und allgemeine Chemie (Popularity: )
(Score: 12.43)
http://www.wiley-vch.de/publish/en/journals/alphabeticIndex/2260/
Publishes original papers from all areas of inorganic chemistry, molecular chemistry, solid state chemistry, and complex chemistry.
Category:
Main\Science\Chemistry\Publications\Journals
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Jerome Baudry (Popularity: )
(Score: 12.39)
http://www.ks.uiuc.edu/~jerome/
Applications of molecular modeling and computational chemistry to biophysics of large, integrated bio-systems.
Category:
Main\Science\Biology\Biophysics\Research Centers
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Journal of Sulfur Chemistry (Popularity: )
(Score: 12.23)
http://www.tandf.co.uk/journals/titles/17415993.asp
The journal publishes high quality reviews, full papers and communications in the following areas: organic and inorganic chemistry, industrial chemistry, materials and polymer chemistry, biological chemistry and interdisciplinary studies directly related ...
Category:
Main\Science\Chemistry\Organic\Journals
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Boger Group (Popularity: )
(Score: 12.03)
http://www.scripps.edu/chem/boger/
Total synthesis of biologically active natural products, the development of new synthetic methods, heterocyclic chemistry, bioorganic and medicinal chemistry, combinatorial chemistry, the study of DNA-agent interactions, and the chemistry of antitumor ...
Category:
Main\Science\Chemistry\Organic\Research Groups
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Australian Journal of Chemistry (Popularity: )
(Score: 12.03)
http://www.publish.csiro.au/nid/51.htm
publishes research papers from all fields of chemical science and technology, including synthesis, structure, new materials, macromolecules, supramolecular chemistry, biological chemistry, nanotechnology, surface chemistry, and analytical techniques.
Category:
Main\Science\Chemistry\Publications\Journals
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Viewmol (Popularity: )
(Score: 12.02)
http://viewmol.sourceforge.net/
An open-source graphical front end for computational chemistry programs such as Gaussian, Gamess, and Mopac. Available for Linux, FreeBSD, Mac OS X, and other Unices.
Category:
Main\Science\Chemistry\Software\Structural
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Chemistry Department (Popularity: )
(Score: 11.93)
http://www.chemistry.ccsu.edu/
Students pursuing the bachelor of science degree in chemistry may specialize in environmental chemistry or combine the study of chemistry with business management, computer science, or biology.
Category:
Main\Reference\Education\Colleges and Universities\North America
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Journal of Computer-Aided Molecular Design (Popularity: )
(Score: 11.92)
http://www.kluweronline.com/issn/0920-654X
Publishes articles on the theory and the application of computer-based methods in the analysis and design of molecules. This includes theoretical chemistry, computational chemistry, computer and molecular graphics, molecular modeling, protein engineering ...
Category:
Main\Science\Chemistry\Computational\Journals
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Laboratory for Computational and Applied Chemistry (Popularity: )
(Score: 11.70)
http://lcac.ku.ac.th/
Molecular and engineering catalysis. Molecular modeling and drug design.
Category:
Main\Science\Chemistry\Research Groups
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