Computational Chemistry Research Groups

• Science: Chemistry: Research 

• Alán Aspuru-Guzik  - Providing research on theories and applications about electronic structure.
• Angel Rubio  - Group engaging in study of condensed matter physics, nano-bio spectroscopy and biological molecules. Publishes theses and official publications.
• Cambridge University Centre for Computational Chemistry  - Organization covers topics on research, computational, theoretical and quantum chemistry.
• Case Group  - Develops and applies the dynamics and structures of biological chemistry in computer modeling.
• The Center for Computational Chemistry  - Undertaking theoretical and computational methods for application in broad chemical interests.
• Center for Molecular Modeling  - Supplies molecular modeling resources and expertise to the chemical science community.
• Center For Superfunctional Materials  - Offers details of graduate programs, research, members, publications, community and admission.
• Christopher J. Cramer  - Publishes one part of his book, which contains details on the author’s research on computational chemistry.
• Dimitris K. Agrafiotis,Ph.,D.  - Biography of Johnson’s and Johnson’s vice president for pharmaceutical research and development. Includes his publications on related scientific topics.
• Dr J.W Essex Research Group  - Applies drug design for the pharmaceutical industry by working on the molecular level.
• Drug Design Laboratory  - Offers projects, theses and molecular software tools for use in non-profit organizations.
• Gilson Laboratory  - Shows the theory application, computer models and related data about non-covalent binding and molecular recognition.
• Houk Research Group  - Conducting research on organic quantum mechanical methods and systems.
• Jurs Research Group  - Using computer-assisted methods for studies on physicochemical properties, pharmaceutical activity, chemical and genetic toxicity.
• McCammon Group  - Simulating solvent properties of solutions, proteins and membranes.
• Merz Research Group  - Doing theoretical studies on biomolecules. Contains news updates and announcements.
• Mookie Baik  - Investigating in areas of reaction mechanisms and molecular electronic structures.
• National Institute of Standards and Technology Computational Chemistry Group  - Processes documents and workshops related to academic and industrial use of computational chemistry.
• Professor Avinoam Ben-Shaul  - Specializing in theoretical studies of biomolecules. Includes annual report and related sources.
• Professor Dr. Peter Schwerdtfeger  - Pursuing relativistic computations for quantum chemistry.
• Professor Noam Agmon  - Research group for the study of biomolecules and dynamics in condensed phases.
• Professor Ron Elber  - Probes and concludes studies relevant to chemical kinetics, thermodynamics and computational analysis through harnessing technology.
• Professor Ronnie Kosloff  - Constituting research on quantum molecular dynamics and molecular processes.
• Professor Victoria Buch  - Specializes in properties of ice and ice-absorbate systems, Quantum-mechanical and classical simulations of systems and spectra of condensed phases.
• Royal Institute of Technology School of Biotechnology Theoretical Chemistry  - Active in photonic research for further application in the information technology sector.
• Schlegel Group  - Conducts lectures, laboratory work and analysis on science related topics.
• The Sherrill Group  - Addressing problems on quantum mechanical principles and electronic structure theory in related chemistry studies.
• The Siepmann Group  - Engaging in statistical studies on condensed phases, molecular assemblies and phase equilibrium.
• Techniques for Organic Reactions, Visualizations and Spectroscopy  - Acquires drug designs and tallies organic chemical reactions as well as handling spectroscopy services.
• The Theoretical Chemistry Group  - Research deals with electronic structure theory. Features the staff profile, projects and researches.
• The Theoretical Chemistry Group, Oslo, Norway  - Posting in Norweigan for Norweigan chemists about quantum chemistry, molecular response properties, and explicitly correlated electronic wavefunctions.
• The Tidor Group  - Investigating sources in stability, structures and properties of different macromolecules.
• The Truhlar Group  - Experienced in quantum mechanics with dynamics and photochemistry.
• Van Gunsteren Group's  - Researches on molecular dynamics simulations of biomolecular systems.
• William L. Jorgensen Research Group  - Laboratory group designed for computational chemistry. Contains publications and research materials.