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molecular modeling
Related: Molecular - Molecular Biology - Molecular Nutrition - Molecular Electronics - Molecular Imaging

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Journal of Molecular Modeling (Popularity: ) (Score: 19.81)
http://link.springer.de/link/service/journals/00894/tocs.htm
Molecular, protein, peptide and drug design, computational modeling, molecular mechanics/dynamics in the fields of Life Sciences and Chemistry.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Publications

NIH Center for Molecular Modeling (Popularity: ) (Score: 19.14)
http://cmm.cit.nih.gov/modeling/
Supplier of molecular modeling resources and expertise to the NIH research community. Development and application of theoretical and computational methodologies, from ab initio calculations of small organic molecules to molecular mechanics simulations ...
Category:   Main\Science\Chemistry\Computational\Research Groups

CMM (Popularity: ) (Score: 18.14)
http://cmm.info.nih.gov/modeling/
Center for Molecular Modeling: Several tutorials related to molecular modeling, directory of software and links to databases.
Category:   Main\Science\Chemistry\Computational

Periodic Table of Parameters (Popularity: ) (Score: 16.63)
http://www.chamotlabs.com/Freebies/Table/parameters-table.html
[Basic] This table lists and describes some well documented and validated parameter sets available for modeling each element by Molecular Mechanics and Quantum Mechanics molecular modeling methods.
Category:   Main\Science\Chemistry\Periodic Table

Computational Chemistry List (Popularity: ) (Score: 16.44)
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

B: On-line Molecular Modeling (Popularity: ) (Score: 16.36)
http://www.scripps.edu/case/Biomer/
"B" (formerly known as Biomer) is a Java-based molecular modeling program for small organic molecules and biopolymers. Supports nucleic acids (DNA/RNA), polypeptides, polysaccharides, the AMBER force field, geometry optimization, simulated ...
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Biomolecules

Journal of Molecular Modeling (Popularity: ) (Score: 15.69)
http://link.springer.de/link/service/journals/00894/tocs.htm
Publishes articles on Life Science Modeling (including QSAR, data mining/bioinformatics, structure and substructure search), Materials Modeling, New Methods, and Computational Chemistry in an interdisciplinary manner and within very short publicationtimes ...
Category:   Main\Science\Chemistry\Computational\Journals

Molecular Conceptor (Popularity: ) (Score: 15.59)
http://www.molecular-conceptor.com/
A multimedia course for Windows that teaches drug design and molecular modeling.
Category:   Main\Science\Chemistry\Software\Educational

Laboratory for Computational and Applied Chemistry (Popularity: ) (Score: 15.51)
http://lcac.ku.ac.th/
Molecular and engineering catalysis. Molecular modeling and drug design.
Category:   Main\Science\Chemistry\Research Groups

Babel - A Molecular Structure Information Interchange Hub (Popularity: ) (Score: 15.37)
http://smog.com/chem/babel/
A program designed to interconvert a number of file formats currently used in molecular modeling.
Category:   Main\Science\Chemistry\Nuclear Magnetic Resonance\Software

Molecular Modeling (Popularity: ) (Score: 15.30)
http://www.molecules.org/
Links to information on chemical structures, graphics, slide shows, and modeling experiments.
Category:   Main\Science\Chemistry\Computational

ArgusLab (Popularity: ) (Score: 15.18)
http://www.planaria-software.com/
A free molecular modeling program for Windows9x operating systems with 3D-builder, various ab initio calculation modules and simple molecular mechanics.
Category:   Main\Science\Chemistry\Software\Physical and Theoretical

Ilya Balabin (Popularity: ) (Score: 15.18)
http://www.ks.uiuc.edu/~ilya/
Works on large-scale computational biochemistry and biophysics, bioinformatics, molecular modeling and design, and molecular machines at UIUC.
Category:   Main\Science\Biology\Biophysics\Research Centers

Journal of Computer-Aided Molecular Design (Popularity: ) (Score: 14.99)
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

TINKER (Popularity: ) (Score: 14.97)
http://dasher.wustl.edu/tinker/
A free molecular modeling package for molecular mechanics and dynamics, with some special features for biopolymers. Distributed as source code and as binaries for Windows9x, Linux and Mac.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Biomolecules

MolySym, Inc. (Popularity: ) (Score: 14.15)
http://www.molysym.com/
Develops novel computer interface products to make the manipulation and simulation of molecular systems easy and intuitive. MolySym provides a unified software/hardware package for molecular modeling and computational chemistry.
Category:   Main\Science\Chemistry\Software\Companies

Ghemical (Popularity: ) (Score: 14.15)
http://www.uku.fi/~thassine/ghemical/
An easy-to-use molecular editor and modeling package with all-atoms molecular mechanics, reduced protein models and links to many common chemistry programs. Ghemical is released under the GNU GPL and includes source code.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Biomolecules

AMMP- Molecular Dynamics, Structural Bioinformatics at Georgia State. (Popularity: ) (Score: 13.87)
http://www.cs.gsu.edu/~cscrwh/ammp/ammp.html
AMMP is a modern full-featured molecular mechanics, dynamics and modeling program
Category:   Main\Science\Math\Applications\Complex Systems

Baik Group (Popularity: ) (Score: 12.76)
http://mypage.iu.edu/~mbaik/home.htm
Computational chemistry and molecular modeling.
Category:   Main\Science\Chemistry\Computational\Research Groups

Applied Modeling Inc. (AMI) (Popularity: ) (Score: 12.55)
http://www.amiace.com
Consultants (in Woodland Hills, California, USA) who offer services in: dispersion modeling (using ISCST3 model); regional air quality modeling (for ozone and for particulate matter); urban airshed modeling; and accidental release modeling (using ALOHA ...
Category:   Main\Science\Environment\Air Quality\Air Dispersion Modeling

Case, Fiona (Popularity: ) (Score: 12.49)
http://www.casescientific.com
Molecular modeling of surfactants and polymers with an industrial focus.
Category:   Main\Science\Chemistry\Computational\People

Biochemical Algorithms Library (Popularity: ) (Score: 12.36)
http://www.bioinf.uni-sb.de/OK/BALL/
C++ framework for rapid software prototyping in molecular modeling.
Category:   Main\Science\Biology\Bioinformatics\Software

The Journal of Conceptual Modeling (Popularity: ) (Score: 12.31)
http://www.inconcept.com/JCM
Free on-line publication dedicated to conceptual modeling techniques such as Object-Role Modeling, Natural Language Modeling and the Unified Modeling Language. Related resources.
Category:   Main\Computers\Computer Science\Publications\Journals

Molecular Modeling Heidelberg (Popularity: ) (Score: 12.23)
http://www.dkfz-heidelberg.de/spec/
Offers a number of free online services; focus is on carbohydrates.
Category:   Main\Science\Chemistry\Computational\Research Groups

Computational Biology and Chemistry (Popularity: ) (Score: 12.13)
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

Jerome Baudry (Popularity: ) (Score: 12.11)
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

Journal of Chemical Information and Modeling (JCIM) (Popularity: ) (Score: 11.95)
http://pubs.acs.org/journals/jcisd8/
Covers topics such as database search systems, use of graph theory in chemical problems, substructure search systems, pattern recognition and clustering, analysis of chemical and physical data, molecular modeling, graphics and natural language interfaces ...
Category:   Main\Science\Chemistry\Computational\Journals

Mitchell Group (Popularity: ) (Score: 11.86)
http://www-mitchell.ch.cam.ac.uk/
Molecular aggregation, protein ligand-interactions, prediction of molecular properties, and the molecular basis of odor.
Category:   Main\Science\Chemistry\Research Groups

MathMol (Popularity: ) (Score: 11.75)
http://www.nyu.edu/pages/mathmol/
Provides students, teachers and researchers the basic concepts in mathematics and their connection to molecular modeling. Links to Software, 3D libraries and tutorials.
Category:   Main\Science\Chemistry\Computational

Molecular Sciences Institute (Popularity: ) (Score: 11.75)
http://www.molsci.org/
Independent non-profit research laboratory combining genomic experimentation and computer modeling, Berkeley, California, USA.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Gene Expression

Drug Design Laboratory, Milan University (Popularity: ) (Score: 11.75)
http://users.unimi.it/~ddl/
Molecular modeling resources, software and projects. Home of the programs Vega and BioDock.
Category:   Main\Science\Chemistry\Computational\Research Groups

Accelrys, Inc (Popularity: ) (Score: 11.75)
http://www.accelrys.com/
Producer of various molecular modeling and simulation software for both life and materials science research, like cerius, catalyst, insightII, quanta.
Category:   Main\Science\Chemistry\Software\Companies

Molecular and Biochemical Parasitology (Popularity: ) (Score: 11.68)
http://www.sciencedirect.com/science/journal/01666851
Publishes investigations of the molecular biology, molecular immunology and biochemistry of parasitic protozoa and helminths and their interactions with both the definitive and intermediate host.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Publications

Theoretical Biology and Biophysics (Popularity: ) (Score: 11.63)
http://www.t10.lanl.gov/
This group (T-10) at Los Alamos National Laboratory focuses on the modeling, analysis and informatics of molecular and cellular biological data.
Category:   Main\Science\Biology\Biophysics\Research Centers

Molecular Device Design Group (Popularity: ) (Score: 11.62)
http://www.soton.ac.uk/~moldev/
Molecular electronics and molecular recognition.
Category:   Main\Science\Chemistry\Physical\Research Groups

Molecular Modeling Laboratory (Popularity: ) (Score: 11.44)
http://cesario.rutgers.edu
Includes information on the software used, one course that uses the laboratory, and links to the personal pages of lab personnel.
Category:   Main\Reference\Education\Colleges and Universities\North America

FSU Institute of Molecular Biophysics (Popularity: ) (Score: 11.41)
http://www.sb.fsu.edu
Contains information on the Structural Biology Research Emphasis, Center of Excellence, Biomolecular Computer Modeling, and Ph.D. Program at Florida State University.
Category:   Main\Science\Biology\Biophysics\Research Centers

The Knowledge Foundation - Molecular Motors (Popularity: ) (Score: 11.40)
http://www.knowledgefoundation.com/molecular2000.html
Force Generation by Molecular Motors, Bio/Synthetic Use of Molecular Motors for Nanotech Applications, and Biomedical Applications of Molecular Motors. Cambridge, Massachusetts.
Category:   Main\Science\Technology\Nanotechnology\Conferences

Molecular Biology Software (Popularity: ) (Score: 11.33)
http://www.yk.rim.or.jp/~aisoai/soft.html
Range of biological software for DNA sequencing, molecule modeling, polymerase chain reaction, and taxonomy.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\Software

Goodsell, David S. (Popularity: ) (Score: 11.30)
http://www.scripps.edu/pub/goodsell/
Attempt to add esthetic appeal to molecular graphics and modeling research by author of Lexitropsin; DNA information-reading molecules, at Scripps Institute, La Jolla, California.
Category:   Main\Science\Biology\Biochemistry and Molecular Biology\People

 
 
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