Software for Hydrophobicity, Indices, 3D Lattice



 eduSoft, LC provides unique computational chemistry functionality interfaced
 to standard molecular modeling packages (Insight, Sybyl, Chem-X).  HINT
 is a standard in logP and hydrophobicity and hydropathic interactions
 evaluation.  Molconn-Z is a standard for generating molecular indices used for
 QSAR.  A new program HASL, will become available shortly that offers unique 3D
 lattice functionality for QSAR problems.
 HINT ###################
 -calculates logP and graphs 3D hydrophobicity: useful in drug database screens
 -constructs complementary maps of hydrophobicity: useful to refine drug design
 -contains functionality for scoring and visualizing ligand/inhibitor docking
 -calculates errors in PBD structures and predicts stability of mutants
 Molconn-Z ##############
 -calculates molecular connectivity, shape, e-state, and information indices
 -environment allows data to be used with PLS, component and other analyses
 -useful for similarity analysis in database searching
 HASL ###################
 -deconvolutes complex 3D problem by assigning values to a 3D lattice
 -used in 3D QSAR for DHFR, glutamine syntase, HIV protease
 -useful in analysing experimental data and predicting results of new drugs
 For more information please contact me, Dr. David N. Haney, at haney #*at*#
 hbond.com,
 or take a look at the web site ####  http://www.eslc.vabiotech.com/ ####
 --
     **************  David N. Haney, Ph.D.    ********************
     *  Haney Associates               Phone - 206-232-1401      *
     *  4212 93rd Ave SE                 FAX - 206-236-5268      *
     *  Mercer Island, WA 98040        Email - haney #*at*# hbond.com   *
     *                                                           *
     **************  http://www.hbond.com/    ********************