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Modelling and molecular dynamics simulation of novel anticancer ligand for restructuring mutant P53 into wild type.

Ashik ChhetriMoloy RoyAditi GangopadhyayAchintya SahaPuja MishraAmit Kumar HalderSouvik Basak
Published in: Int. J. Comput. Biol. Drug Des. (2022)
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • high performance computing
  • scientific data
  • protein folding
  • computational methods
  • data generation
  • numerical simulations