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HINT

HINT (Hydrophobic INTeractions) calculates 3D hydropathy fields and 3D hydropathic interaction maps that are useful as tools for 3D QSAR and biomacromolecular structure, as well as:

  1. Estimates LogP for modeled molecules in InsightII or Sybyl
  2. Provides SMILES-based tools for molecule building using the Daylight Toolkit and the Biosym Sketcher module (available in Hint 2.1I).
  3. Numerically and graphically evaluates binding of drugs or inhibitors into protein structures and scores DOCK (UCSF) orientations.
  4. Constructs hydropathic (LOCK and KEY) complementarity maps that can be used to predict an ideal substrate from a known receptor or protein structure or to propose the hydropathic structure from known agonists or antagonists.
  5. Evaluates/predicts effects of site-directed mutagenesis on protein structure and stability.

The HINT home page can be viewed at URL: http://www.eslc.vabiotech.com/hint

Other WWW on-line info is available at:

manuals: http://www.eslc.vabiotech.com/hint/manuals/230/



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