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Molecular Docking Web (Popularity:  )
Protein-ligand Docking, structures, bioinformatics, computational chemistry, and drug design resources.
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Computational Chemistry List (Popularity: )
A resource for computational chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular ...
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Computational Chemistry and Organic Synthesis (Popularity: )
A tutorial intended for experimental organic chemists, with emphasis on computational methods for locating and ...
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Virtual Computational Chemistry Laboratory (Popularity: )
Provides interactive on-line calculation of physico-chemical properties (logP, aqueous solubility), molecular descriptors (E-Dragon, fragmental and ...
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Computational Chemistry Comparison and Benchmark Database (Popularity: )
Database of molecules with well established heat of formation, no atoms with atomic number greater ...
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MathMol (Popularity: )
Provides students, teachers and researchers the basic concepts in mathematics and their connection to molecular ...
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Molecular Modeling (Popularity: )
Links to information on chemical structures, graphics, slide shows, and modeling experiments.
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CMM (Popularity: )
Center for Molecular Modeling: Several tutorials related to molecular modeling, directory of software and links ...
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Cambridge University Silicon Graphics Teaching Laboratory (Popularity: )
An outline of a course in computational chemistry. Includes exercises in conformational search, molecular dynamics, ...
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First Principles Research, Inc. (Popularity: )
Research Theorists in Physics and Chemistry.
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Molecular Docking Server (Popularity: )
DockingServer is an internet service that calculates the site, geometry and energy of small molecules ...
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EPSRC National Service for Computational Chemistry Software (Popularity: )
Provides software, specialist consultation, computing resources, and software training to support UK academics. Directions, staff, ...
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Delivering Science (Popularity: )
Scienomics develops, implements and distributes state-of-the-art simulation technology for the material science R&D within one ...
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