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Integrating microsecond timescale classical and biased molecular dynamics simulations to screen potential molecules for BRD4-BD1

Vijay Kumar Bhardwaj, Pralay Das, Rituraj Purohit

2023Chaos Solitons & Fractals14 citationsDOI

Topics & Concepts

MicrosecondMolecular dynamicsDynamics (music)Chemical physicsMoleculeStatistical physicsPhysicsMaterials scienceChemistryNanotechnologyComputational chemistryOpticsQuantum mechanicsAcousticsProtein Degradation and InhibitorsReceptor Mechanisms and SignalingAdvancements in Semiconductor Devices and Circuit Design
Integrating microsecond timescale classical and biased molecular dynamics simulations to screen potential molecules for BRD4-BD1 | Litcius