Understanding the Mechanism of the Hydrogen Abstraction from Arachidonic Acid Catalyzed by the Human Enzyme 15-Lipoxygenase-2. A Quantum Mechanics/Molecular Mechanics Free Energy Simulation

  1. Suardíaz, R.
  2. Jambrina, P.G.
  3. Masgrau, L.
  4. González-Lafont, À.
  5. Rosta, E.
  6. Lluch, J.M.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Year of publication: 2016

Volume: 12

Issue: 4

Pages: 2079-2090

Type: Article

DOI: 10.1021/ACS.JCTC.5B01236 GOOGLE SCHOLAR

Sustainable development goals