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Dissecting the molecular mechanism of cepharanthine against COVID-19, based on a network pharmacology strategy combined with RNA-sequencing analysis, molecular docking, and molecular dynamics simulation.

Jiaqin LiuTaoli SunSa LiuJian LiuSenbiao FangShengyu TanYucheng ZengBikui ZhangWenqun Li
Published in: Comput. Biol. Medicine (2022)
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • high performance computing
  • scientific data
  • data analysis
  • peer to peer
  • fluid flow
  • database
  • data collection