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The next revolution in computational simulations: Harnessing AI and quantum computing in molecular dynamics

Anna Lappala

2024Current Opinion in Structural Biology54 citationsDOIOpen Access PDF

Topics & Concepts

InterpretabilityComputer scienceMultidisciplinary approachExploitMolecular dynamicsComputational modelData scienceArtificial intelligenceComputational scienceChemistrySocial scienceSociologyComputer securityComputational chemistryMachine Learning in Materials ScienceProtein Structure and DynamicsQuantum Computing Algorithms and Architecture
The next revolution in computational simulations: Harnessing AI and quantum computing in molecular dynamics | Litcius