SimBioSys® designs and develops computational chemistry software products in the area of molecular modeling, e.g. software tools for rational drug design. These software tools support the design and optimization of small, organic therapeutics both in cases when a protein structure is available, and also in cases when only a pharmacophore model is given, e.g. generated from the overlay of the 'hit' molecules from high throughput screening. Our software products are distinguished by high quality scientific modeling and accurate predictions achieved by robust, deterministic and exhaustive algorithms innovated by SimBioSys®. Such algorithms are unique in the industry for providing guaranteed success and optimal solutions for every problem. (for example: docking, 3D virtual high throughput screening, de-novo design etc.)
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Open Archives as a Route for the Capture, Dissemination and Access to Chemical Information –
Simon Coles, University of Southampton