TerraQSAR - SKIN
Profile: | SKIN Irritation Computation Program |
Purpose: | Stand-alone neural network-based program to compute the skin irritation potential of organic chemicals for the rabbit (Draize test) |
Computation Input: | A chemical's SMILES string. |
Computation Algorithm: | Proprietary probabilistic neural network algorithm. |
Computation Speed: | Results are available within seconds. |
Computation Output: | The computed skin irritation potential in scalar units, between 0.00 (non-irritating) and 2.00 (severely itrritating), and the molecular weight of the compound. |
Manual / Help System: | Built-in; request a complimentary full copy of the TerraQSAR - SKIN Manual by email, or download it here in pdf format (TerraQSAR-SKIN.pdf). |
Distribution Medium: | CD-ROM. |
Operating System: | Windows 98, Windows NT4, Windows ME; Windows XP. |
Hardware Requirements: | Pentium IV, 1 GHz (higher recommended), 32MG RAM, 30MG HDD, mouse (or equivalent), CD-ROM, monitor with 800 x 600 or higher resolution using 256+ colors. |
Price: | See: Pricing. |
Availability: | Released: Vers. 1.1, Aug., 2005. |
Limited time offer for free predictions: | Send structures by EMAIL as SMILES strings (must be in Accelrys notation) or by FAX as drawings. |
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