| Overview of software
products offered by Molecular Networks: |
|
 2DCOOR |
coordinates generator for publishing
quality 2D depictions |
| ADRIANA |
combination of the two packages ADRIANA.Code
and SONNIA
to provide algorithms for the search, identification and optimization
of hits and lead structures |
| ADRIANA.Code |
calculation of molecular descriptors
encoding physicochemical, topolocical, geometrical and surface
properties |
| BioPath |
database on biochemical pathways derived
from the Roche Applied Science "Biochemical Pathways" wall chart |
| BioPath.Explore |
biochemical pathways database BioPath integrated into the web-based retrieval system C@ROL |
| C@ROL |
data warehousing for 2D structures,
multiple 3D conformations, and
experimental information |
| CHECK |
structure integrity check and
normalization of chemical state |
| CONVERT |
inter-conversion of 40 different
chemical file formats |
| CORINA |
3D structure generation |
| CORINA_F |
CORINA interfaced to FlexX docking
program |
| FM3D |
3D visualization of molecules |
| IMAGE |
conversion of chemical files into images |
| isoCYP |
prediction of the predominant isoform of human cytochrome P450 substrates |
| PAGE |
conversion of chemical files into
formatted documents |
| ROTATE |
generation of ensemble of conformations |
| SONNIA |
self-organizing neural network package |
SPLIT/JOIN
&MERGE |
package for splitting a chemical file
including n structuers into n
files, joining n structure files to one single file
or merging structure and data files into a single file |
| STERGEN |
enumeration of stereoisomers |
| SYLVIA |
estimation of the synthetic accessibility of organic compounds |
| TABLE |
conversion of chemical files into
spreadsheet compatible file formats |
| TAUTOMER |
enumeration of tautomers |
| WODCA |
synthesis design by retro-synthetic
analysis
(not distributed/supported anymore) |
|
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