by Thanos Panagiotidis | Sep 30, 2016 | Presentations and Webinars, Videos
Using Cresset’s Electrostatics to Inform 3D Molecular Design In this webinar, held on 29 September 2016, Tim Cheesright of Cresset described how they use electrostatics to inform 3D molecular design in their Torch software. To hear the narration, please increase...
by Thanos Panagiotidis | Sep 7, 2016 | Downloads, Scripts/Addons
eMolecules Plug-in for StarDrop This script enables you to search the commercial compound vendor lists aggregated by eMolecules. This allows searching of compounds from multiple suppliers and returns details about the available compounds. Take a look at this short...
by Thanos Panagiotidis | Sep 5, 2016 | In Silico Modelling, Publications and presentations
Predicting interactions of compounds and metabolites with toxicity-associated targets Peter Hunt gave this presentation at the ACS Fall 2016 National Meeting & Exposition held in Philadelphia, USA. Abstract We describe the development of quantitative structure...
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