Merz Research Group
  • Home
  • Merz
  • Openings
  • Team
  • Research
  • JCIM
  • AMBER
  • Publications
    • Publications 1980-1989
    • Publications 1990-1994
    • Publications 1995-1999
    • Publications 2000-2004
    • Publications 2005-2009
    • Publications 2010-2014
    • Publications 2015-2020
    • Publications 2021-2025
  • Software
    • KECSA RF Model
    • MTK++/MCPB
    • HeatMap
    • DivCon
    • MC Error Estimation
    • QUICK
    • HECSP
  • DBs
  • Links
  • Photos
    • JACS Cover
    • AMBER 12 Cover
    • Angkor
    • Istanbul
    • Petra
    • Alhambra
    • Greece
    • Barcelona
    • Florence
    • Rome
    • Pisa
    • Barcelona >
      • Parc Güell
  • News

Happy New Years 2023! 

Picture
We are involved in research at the interface between the computational sciences and biology. We work on a number of problems and collaborate with experimentalists at every opportunity. Research areas of most interest include computer-aided drug design (CADD), using free energy methods to compute relative and absolute free energies of biological processes, metal ion force field design, metalloenzymes and metal ion homeostasis, development and application of quantum mechanical methods to biological problems and development of metabolomics workflows for NMR and CS computations. For further details go to the research section and look over our publications. Link on the images below for some of our recent publications. ​

Picture
The Portal for Open Computational Metabolomics Tools (POMICS) provides advanced computational methods to the metabolomics community.

Picture

Picture