[BIOVIA] Computational Chemist

User Experience Value

In Discovery Studio Simulation, working with a molecular dynamics trajectory users can identify motion and changes in one protein feature relative to other features. In Generative Therapeutics Design, users will be able to bias the results of experiments towards the portions of chemical space covered by the WuXi GalaXi virtual library which can be quickly synthesized on-demand.

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Video

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Analyze allosteric motions from trajectories using features of interest

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A new Galaxi Likelihood model helps to generate molecules that have a higher likelihood of availability for purchase

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User preferences allow configuration of how docking results display