Folding.bmc.uu.se - David van der Spoel Sunday, 16 December 2018
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Research
Monday, 16 January 2006
The main research focus of the lab is on computational chemistry, in particular protein folding, studies of radiation damage and force field testing and development. 
  1. Force field development and new simulation methodology. Check out our website http://virtualchemistry.org for GROMACS input files for small molecules and output from MD simulations and quantum chemistry.
  2. Virus biology and infection in atomic detail
  3. Software development for GROMACS: the world's fastest molecular dynamics (MD) and trajectory analysis software. Available under the Library GNU public license.
  4. Protein folding and structure prediction using molecular dynamics simulations.
  5. Hydrogen bonding dynamics and thermodynamics in relation to the hydrophobic effect.
 
(c) 2006 David van der Spoel