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Exploring the distinct activation mechanisms of neuromedin B receptor through multiple replica molecular dynamics simulations and Markov state modeling

Nuan Li, Ming-Yuan Yang, Mingyang Zhang, Ning Liu, Aiwu Zhou, Zong‐Tao Chai, Shaoyong Lu

2025Acta Pharmacologica Sinica9 citationsDOI

Topics & Concepts

Molecular dynamicsReplicaMarkov chainDynamics (music)ReceptorState (computer science)Computational biologyChemistryComputer scienceStatistical physicsBiologyPhysicsBiochemistryComputational chemistryAlgorithmGeographyAcousticsMachine learningArchaeologyReceptor Mechanisms and SignalingNeuropeptides and Animal PhysiologyMonoclonal and Polyclonal Antibodies Research
Exploring the distinct activation mechanisms of neuromedin B receptor through multiple replica molecular dynamics simulations and Markov state modeling | Litcius