Moira successfully defended her thesis entitled “Fragment-to-Lead Optimization with Automated and Iterative Virtual Screening”. Her Fragment Evolution Automated platform (FrEvolAtion) has shown to be a powerful tool for Fragment-based Drug Discovery and her results finding binders for the NUDT1, BRD4, HSP90 and other kinases thoroughly validate the reach of the methodology. We hope you have […]

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From the 15th to 16th of July the Gordon Research Seminar on Computer Aided Drug Design took place. Maciej presented an oral communication entitled “Extending the Quasi-Bound concept to multiple interaction points”. Moira presented the poster “FrEvolAtion: Fragment Evolution Automation. A means to rescue interesting fragments that fail to crystallize”, which was also presented in the Gordon Research Conference, […]

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