chemicalize.org gets search and goes beta

ChemAxon 6c76bc6409

02-11-2010 12:48:01

Today we have upgraded chemicalize.org with major new features in the works for over 2 months.  A search interface is now available to discover structures and URLs from our database of previously chemicalized webpage. Head over to chemicalize.org to try it out, below you can find the complete changelog:


* webpage parser is upgraded to version 5.4, this is a major upgrade
  structure parsing and name to structure conversion is now a lot more accurate
* new search interface is available
    - searches the structures and webpages visited by the webpage parser
    - database currently contains 43000 structures with 71000 names and 157000 URLs
    - substructure, similarity and exact match search types supported
    - structures are ranked by a drug-likeness index or similarity value
    - URLs are ranked by the number of appearances of the query structure on the page
    - related structures and related URLs are available for each URL result
    - uses ChemAxon's JChem Webservices as a search backend
* frontpage redesigned
    - validate input as you type
    - structure suggestions as you type, structures sorted by exact match, popular suffixed
      matches and then typo corrected matches
    - drag & drop files from desktop onto input field (supported by Mozilla Firefox 3.6+
      and Google Chrome)
    - query structures are now saved as MRV files to preserve all query features, these
      appear as structureIds in the input boxes
* structure properties page upgraded
    - Calculator Plugins upgraded to version 5.4
    - geometry calculation's box is now all black
    - generated images are now SVG vector images, improving page load times (supported
      by Mozilla Firefox 3.5+, Opera 9.5+, Apple Safari 5+ and Google Chrome)
    - displayed structures are now dearomatized instead of using Kekule form
    - the expand option is removed from boxes with text only
    - advanced input button added to the toolbars, this makes all the input capabilities
      of the frontpage available on this page as well