Computational Chemistry

ADVANTAGE in Computational Chemistry Services and Consulting:

Rebexsess offers unique and outstanding computational chemistry consulting and service. Our computational chemists are professionally trained in Medicinal Chemistry with extensive hands-on experience of computational chemistry, practical approaches and deep understanding the cycle of drug discovery, which results in that the molecules from our design are potency desirable, synthesis accessible and drug-property favorable.

Service Aspects of Protein Structure for Ligand Analysis and Design

  • Use of structure to improve potency and selectivity
  • Use of structure to improve drug-like?properties
  • Computational docking of small molecules to proteins
  • Computational analysis of docked pose
  • Development of SAR in context of receptor
  • Virtual screening of small molecule libraries


    • The Computational Chemistry Impact to a Process of Small Molecule Discovery Chemistry:

    Computational chemistry consulting