• search
    search
  • reviewers
    reviewers
  • feeds
    feeds
  • assignments
    assignments
  • settings
  • logout

Molecular Dynamics Simulation, Free Energy Calculation and Structure-Based 3D-QSAR Studies of B-RAF Kinase Inhibitors.

Ying YangJin QinHuanxiang LiuXiaojun Yao
Published in: J. Chem. Inf. Model. (2011)
Keyphrases
  • molecular dynamics
  • free energy
  • molecular dynamics simulations
  • protein folding
  • high performance computing
  • three dimensional
  • upper bound
  • markov random field