Effect of set up protocols on the accuracy of alchemical free energy calculation over a set of ACK1 inhibitors

  1. Granadino-Roldán, J.M.
  2. Mey, A.S.J.S.
  3. Pérez González, J.J.
  4. Bosisio, S.
  5. Rubio-Martinez, J.
  6. Michel, J.
Journal:
PLoS ONE

ISSN: 1932-6203

Year of publication: 2019

Volume: 14

Issue: 3

Type: Article

DOI: 10.1371/JOURNAL.PONE.0213217 GOOGLE SCHOLAR lock_openOpen access editor

Sustainable development goals

Data source: Scopus