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Deciphering the molecular choreography of Janus kinase 2 inhibition via Gaussian accelerated molecular dynamics simulations: a dynamic odyssey.

Md Fulbabu SkSunanda SamantaSayan PoddarParimal Kar
Published in: J. Comput. Aided Mol. Des. (2024)
Keyphrases
  • molecular dynamics simulations
  • molecular dynamics
  • three dimensional
  • sequence alignment
  • data processing