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Sponsored Links:
Znamenskiy, Vasiliy S. (Popularity:  )
http://userhome.brooklyn.cuny.edu/vznamenskiy/index.html
Molecular dynamics simulations of condensed phases, with an emphasis on ionic liquids.
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Aspuru-Guzik, Alan (Popularity: )
http://alan.aspuru.com
Theoretical physical chemistry. In particular, interested in the electronic structure of atoms and molecules and in statistical mechanics.
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Ryzhkov, Andrew (Popularity: )
http://redandr.tripod.com
Theoretical modeling of chemical systems and quantum chemical investigation of reaction mechanisms. Simulation of complex non-linear chemical reactions. Curriculum vitae an software.
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Agrafiotis, Dimitris K. (Popularity: )
http://www.dimitris-agrafiotis.com/
Personal web site including references on computer-assisted combinatorial chemistry, diversity analysis and structure-based drug design.
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Chihaia, Viorel (Popularity: )
http://vchihaia.tripod.com
Atomic scale simulation through Hartree-Fock and density functional theories. Curriculum vitae, projects, publications, and software.
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Baer, Roi (Popularity: )
http://www.fh.huji.ac.il/~roib/
Electronic structure of large systems; quantum molecular dynamics simulations.
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Pyykkö, Pekka (Popularity: )
http://www.chem.helsinki.fi/~pyykko/
Ab initio quantum chemistry with a particular focus on relativistic calculations; nuclear quadrupole moments.
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Stone, Anthony (Popularity: )
http://www-stone.ch.cam.ac.uk/
Adsorption on ionic crystal surfaces, the Orient program for calculating structures and properties of weakly-bound systems, and the development of simple but accurate methods for describing intermolecular forces.
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Nonella, Marco (Popularity: )
http://homepage.mac.com/marcononella
Density functional and ab initio studies of biologically relevant chromophores.
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Patchkovskii, Serguei (Popularity: )
http://www.cobalt.chem.ucalgary.ca/ps/
Theoretical and physical chemistry, semiempirical molecular orbital methods.
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McCoy, Anne B. (Popularity: )
http://www.chemistry.ohio-state.edu/~mccoy/home/mccoy-home.html
Theoretical studies of weakly bound clusters and of reaction dynamics in clusters and in solution.
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Constans, Pere (Popularity: )
http://www.molspaces.com
Molecular similarity theory, quantum chemistry, and numerical algorithms.
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Zapalowski, Michal (Popularity: )
http://zapalowski.fotomis.com
Computer research of ionic solutions, radicals and biologically important molecules by classical and quantum mechanical modeling.
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