AmbitXT v 2.2.0

• November 2009 : Download AmbitXT 2.2.0 release
  • Windows setup with an embeded MySQL database
    • integrated Toxtree (Toxtree modules available from the Descriptor calculation interface);
      • included chemical structure data, gathered from several independent sources;
      • Improved performance;
      • Updated Toxtree modules
  • Technical Guide
  • User Manual
  • Manual for PBT assessment module
  • The included database encompasses substances from the following sources:

  -- ECHA Preregistration list

  -- Bioconcentration factor (BCF) Gold Standard Database

  -- ECETOC Aquatic Toxicity (EAT) Database Supplement to ECETOC. 2003. Aquatic Hazard Assessment II. Technical Report No. 91. European Centre for Ecotoxicology and Toxicology of Chemicals, Brussels, Belgium

  -- Compilation of historical local lymph node assay data for the evaluation of skin sensitization alternatives. Gerberick GF, Ryan CA, Kern PS, Schlatter H, Dearman RJ, Kimber I, Patlewicz G, Basketter DA. (2005). Dermatitis 16(4): 157-202.

  -- Skin irritation and corrosion Reference Chemicals data base (1995) ECETOC Technical Report No. 66

  -- DSSTox EPAFHM: EPA Fathead Minnow Acute Toxicity

  -- FDAMDD: FDA Maximum (Recommended) Daily Dose

  -- IRISTR: EPA Integrated Risk Information System (IRIS) Toxicity Review Data

  -- KIERBL: EPA Estrogen Receptor Ki Binding Study (Laws et al.)

  -- CPDBAS: Carcinogenic Potency Database Summary Tables - All Species

  -- ISSCAN: Istituto Superiore di Sanita, CHEMICAL CARCINOGENS: STRUCTURES AND EXPERIMENTAL DATA

Previous releases

• June 2009 AmbitXT v2.1.0
  • Download Windows setup with an embeded MySQL database, containing 100204 EINECS chemicals with calculated properties
  • added new functionality for consistency verification of structures and identifiers;
  • Fast SMARTS database searching

• May 2009 AmbitXT v2.0.2
  • Download Windows setup with an embeded MySQL database, containing 100204 EINECS chemicals with calculated properties
  • PBT module bug fixes and enhancements
  • Initial implementation of fast SMARTS database searching
• May 2009 AmbitXT v2.0.1
  • Download Windows setup with an embeded MySQL database, containing 100204 EINECS chemicals with calculated properties.
  • Download Windows setup with an embeded MySQL database, no chemicals imported.
  • Quick Guides for first time users
  • User Manual
  • Improved user interface
  • Flexible search workflows
  • Initial implementation of category building workflow
  • Updated workflow for PBT assessment, following REACH guidance.
• Feb 2009 AmbitXT v2.0.0
  • Download AmbitXT Initial release Beta version of the software.
  • Updated database schema
  • Workflow support
  • Example workflow for identifiers, substructure and similarity search.
  • Workflow for PBT assessment, following REACH guidance.
  • The database distributed contains the original EINECS list.
• Oct 2008
  • Prototype version of the software, incorporating updated database schema and functionalities and workflow support, with an example workflow for identifiers, substructure and similarity search. The database distributed contains the original EINECS list.

For older AMBIT releases, please visit AMBIT site