11. Computational Chemistry List
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
http://www.ccl.net/chemistry/
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Rating: [0.00] Votes: [0] Hits: [391] | May 7, 2006 |
12. Journal of Computer-Aided Molecular Design
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, drug design, expert systems, general structure-property relationships, molecular dynamics, and chemical database development and usage.
http://www.kluweronline.com/issn/0920-654X
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Rating: [0.00] Votes: [0] Hits: [364] | May 7, 2006 |
13. Computational Chemistry Roadmap
Identifies future scientific challenges in computational chemistry from the perspective of the U.S. chemical industry.
http://www.oit.doe.gov/chemicals/visions_compchemistry.shtml
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15. Morrison, Carole
Application of plane-wave density functional theory to molecular systems (University of Edinburgh).
http://www.ed.ac.uk/~cam01
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16. Computational Chemistry Resources
Directory of links related to computational chemistry. Offers several tutorials for understanding the basics of molecular structure and molecular modeling techniques.
http://www.chem.swin.edu.au/chem_ref.html
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17. York, Darrin M.
Studies of nucleic acid chemistry using linear scaling quantum chemistry and hybrid quantum mechanics + molecular mechanics approaches.
http://riesling.chem.umn.edu/~york/
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19. Molecular Mechanics and Dynamics
Practical tutorial on the topic, including an overview of force field selection and applications.
http://www.chem.swin.edu.au/modules/mod6/
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Rating: [0.00] Votes: [0] Hits: [308] | May 7, 2006 |
20. ACS Division of Computers in Chemistry
A unit of the American Chemical Society. Includes newsletters, programs of past and future division meetings, and information on awards presented by the division.
http://membership.acs.org/C/COMP/
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