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Diaminopimelate Epimerase: Insights from Ligand Parameterization, Atomistic Simulation, and Markov State Modeling.

Sunita MuduliSoumyajit KarmakarSabyashachi Mishra
Published in: J. Chem. Inf. Model. (2024)
Keyphrases
  • discrete event simulation
  • agent based modeling
  • state space
  • markov chain
  • simulation model
  • real world
  • high throughput
  • directed acyclic graph
  • simulation models