New 3D-QSAR Package: Galaxy!
Program Galaxy (TM)
The program Galaxy (TM) is a fully menu driven, state of the
art 3D-QSAR program and has several features which are
indispensable tools in the discovery process of novel
molecules, even for cases where the three dimensional
structure of the target is determined. The 3D-QSAR
methodology, which was invented by Dr. Ghose, helps to
design potent inhibitors by taking into account the three
dimensional structural information and relevant
physicochemical properties of the inhibitors. Dr. Ghose
has several successes in designing potent inhibitors by
using this method. In addition, the program has a large
number of facilities to study structural and physicochemical
properties of general organic molecules. The following
descriptions summarize the capabilities of the program
Galaxy (TM).
1. 2D and 3D molecule builder.
2. Physicochemical property estimation of organic
molecules.
3. An elaborate Molecular Mechanics with various
conformational analysis techniques.
4. 3D-Database containing 45,000 organic molecules. Users
can make their own data base.
5. Statistical Fitting Tools.
6. Hanch type QSAR.
7. Pharmacophore Modeling.
8. State of the art 3D-QSAR method. It has both automated
and manual superposition techniques. It can take into
account the hydrophobic, dispersive and electrostatic
interactions very reliably using its atom based properties.
9. Protein Cavity-Quantitative Structure Activity
Relationships.
10. Molecular Orbital Interface.
11. Open interfacing for easy integration of other
methods.
Contact:
AM Technologies Inc. AM Technologies Inc.
14785 Omicron Dr. 1355 St. Peters Rd.
Texas Research Park Pottstown, PA 19464
San Antonio, TX 78218. Phone: (610) 327 0705.
Phone: (210) 677 6000
Fax: (210) 677 6070.