Jagadeesh Mavinahalli

May 2, 2008

Computational Chemistry Links

Filed under: Uncategorized — admin @ 5:22 pm

  • Computational Chemistry Jobs
  • Open Babel: A Package to Decypher Computational Chemistry
  • Map Viewer
  • Basic Molecular Modelling
  • Introduction to the Internet
  • Empirical and semi-empirical molecular orbital theory
  • QSAR
  • Molecular Mechanics and Dynamics
  • Advanced ab initio quantum chemistry
  • Advanced Molecular Modelling
  • Basic ab initio quantum chemistry
  • Minnesota Database Collection
  • SMILES Tutorial
  • Calculation of molecular properties
  • MDPI Molecular Diversity Preservation International
  • Chemoinformatics and Drug Design Resources
  • NetSci: Chemistry Display Software
  • Computational Chemistry Portal
  • NetSci’s Science Center: Computational Chemistry
  • Introduction to QSAR Methodology
  • Computational chemistry software list
  • Docking Presentation
  • Drug Design
  • User manual for LigBuilder v1.2
  • XDrawChem @ sourceforge.net
  • Chemistry Software

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