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• Bayat, Hanif

  http://www.chem.utoronto.ca/~hbayat/
  PhD candidate in the area of theoretical chemical physics at University of Toronto. Includes previous and current academical projects and works.

• Case, Fiona

  http://www.casescientific.com/
  Molecular modeling of surfactants and polymers with an industrial focus.

• Chihaia, Viorel

  http://vchihaia.tripod.com/
  Atomic scale simulation through Hartree-Fock and density functional theories. Curriculum vitae, projects, publications, and software.

• Constans, Pere

  http://www.molspaces.com/
  Molecular similarity theory, quantum chemistry, and numerical algorithms.

• Ercolessi, Furio

  http://www.fisica.uniud.it/~ercolessi/
  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.

• Gupta, Vineet

  http://sites.google.com/site/doctorvineetgupta/
  Research interests in computational chemistry and molecular modeling and their application to biological macromolecules. Includes research profile and publications.

• Kosenkov, Dmytro

  http://www.kosenkov.org/
  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.

• Patchkovskii, Serguei

  http://www.cobalt.chem.ucalgary.ca/ps/
  Theoretical and physical chemistry, semiempirical molecular orbital methods.

• Pyykkö, Pekka

  http://www.chem.helsinki.fi/~pyykko/
  Ab initio quantum chemistry with a particular focus on relativistic calculations; nuclear quadrupole moments.

• Stone, Anthony

  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.

• Zapalowski, Michal

  http://zapalowski.fotomis.com/
  Computer research of ionic solutions, radicals and biologically important molecules by classical and quantum mechanical modeling.

• Znamenskiy, Vasiliy S.

  http://userhome.brooklyn.cuny.edu/vznamenskiy/index.html
  Molecular dynamics simulations of condensed phases, with an emphasis on ionic liquids.

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