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Agrafiotis, Dimitris K. Personal web site including references on computer-assisted combinatorial chemistry, diversity analysis and structure-based drug design. http://www.dimitris-agrafiotis.com/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Bayat, Hanif PhD candidate in the area of theoretical chemical physics at University of Toronto. Includes previous and current academical projects and works. http://www.chem.utoronto.ca/~hbayat/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Carta, Giorgio Research includes the development and application of computational tools to assist the drug discovery process. Also lists publications. http://www.cartagiorgio.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Case, Fiona Molecular modeling of surfactants and polymers with an industrial focus. http://www.casescientific.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Chihaia, Viorel Atomic scale simulation through Hartree-Fock and density functional theories. Curriculum vitae, projects, publications, and software. http://vchihaia.tripod.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Constans, Pere Molecular similarity theory, quantum chemistry, and numerical algorithms. http://www.molspaces.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Ercolessi, Furio Includes a primer on molecular dynamics simulations, course material (in Italian), information on the MDBNCH benchmark for molecular dynamics codes, and links to related materials. http://www.fisica.uniud.it/~ercolessi/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Gupta, Vineet Research interests in computational chemistry and molecular modeling and their application to biological macromolecules. Includes research profile and publications. http://sites.google.com/site/doctorvineetgupta/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Kosenkov, Dmytro Developing ab initio based quantum chemical and multiscale methods for simulations of chemical and biological processes. Includes descriptions of research, a list of publications, recent news, and notes from his teaching assignments. http://www.kosenkov.org/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Naidoo, Kevin J. Studies of macromolecular structure in condensed phases and in solution (University of Cape Town). http://hydrogen.cem.uct.ac.za/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Nonella, Marco Density functional and ab initio studies of biologically relevant chromophores. http://homepage.mac.com/marcononella (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Patchkovskii, Serguei Theoretical and physical chemistry, semiempirical molecular orbital methods. http://www.cobalt.chem.ucalgary.ca/ps/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Pyykkö, Pekka Ab initio quantum chemistry with a particular focus on relativistic calculations; nuclear quadrupole moments. http://www.chem.helsinki.fi/~pyykko/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Richards, Graham Research areas include computer-aided molecular design, enzyme inhibition, membrane simulation and molecular similarity (Oxford University). http://www.chem.ox.ac.uk/researchguide/wgrichards.html (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Ryzhkov, Andrew Theoretical modeling of chemical systems and quantum chemical investigation of reaction mechanisms. Simulation of complex non-linear chemical reactions. Curriculum vitae an software. http://redandr.tripod.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Stone, Anthony 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. http://www-stone.ch.cam.ac.uk/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Sugny, Dominique Research interests include geometry and topology in classical and quantum mechanics, control by laser fields of molecular processes, and structure of molecular dynamics. http://icb.u-bourgogne.fr/OMR/DQNL/Sugny/professionel.html (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Zagidullina, Aygul Includes research interests (quantum chemical investigation of reaction mechanisms), publication list, curriculum vitae, personal details and contact information. http://aygul.nm.ru/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Zapalowski, Michal Computer research of ionic solutions, radicals and biologically important molecules by classical and quantum mechanical modeling. http://zapalowski.fotomis.com (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Znamenskiy, Vasiliy S. Molecular dynamics simulations of condensed phases, with an emphasis on ionic liquids. http://userhome.brooklyn.cuny.edu/vznamenskiy/index.html (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It Znamenskiy, Vasily S Postdoctoral researcher specializing in simulations and quantum mechanical calculations on ionic liquids. Includes CV, publication list, and figures from his research. http://www.znamenskiy.com/ (Added: Mon Apr 04 2011 Hits: 0 Rating: 0.00 Votes: 0) Rate It Review It

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