Effective in silico prediction of new oxazolidinone antibiotics: force field simulations of the antibiotic–ribosome complex supervised by experiment and electronic structure methods

Jörg Grunenberg and Giuseppe Licari
Beilstein J. Org. Chem. 2016, 12, 415–428. https://doi.org/10.3762/bjoc.12.45

Supporting Information

Supporting Information File 1: Computational details.
Format: PDF Size: 406.1 KB Download

Cite the Following Article

Effective in silico prediction of new oxazolidinone antibiotics: force field simulations of the antibiotic–ribosome complex supervised by experiment and electronic structure methods
Jörg Grunenberg and Giuseppe Licari
Beilstein J. Org. Chem. 2016, 12, 415–428. https://doi.org/10.3762/bjoc.12.45

How to Cite

Grunenberg, J.; Licari, G. Beilstein J. Org. Chem. 2016, 12, 415–428. doi:10.3762/bjoc.12.45

Download Citation

Citation data can be downloaded as file using the "Download" button or used for copy/paste from the text window below.
Citation data in RIS format can be imported by all major citation management software, including EndNote, ProCite, RefWorks, and Zotero.

Presentation Graphic

Picture with graphical abstract, title and authors for social media postings and presentations.
Format: PNG Size: 1.7 MB Download

Citations to This Article

Up to 20 of the most recent references are displayed here.

Scholarly Works

  • García-Olaiz, G.; Alcántar-Zavala, E.; Ochoa-Terán, A.; Cabrera, A.; Muñiz-Salazar, R.; Montes-Avila, J.; Salazar-Medina, A. J.; Alday, E.; Velazquez, C.; Medina-Franco, J. L.; Laniado-Laborín, R. Design, synthesis and evaluation of the antibacterial activity of new Linezolid dipeptide-type analogues. Bioorganic chemistry 2019, 95, 103483. doi:10.1016/j.bioorg.2019.103483
  • Selwa, E.; Elisée, E.; Zavala, A.; Iorga, B. I. Blinded evaluation of farnesoid X receptor (FXR) ligands binding using molecular docking and free energy calculations. Journal of computer-aided molecular design 2017, 32, 273–286. doi:10.1007/s10822-017-0054-1
  • Grunenberg, J. Ill-defined chemical concepts: The problem of quantification. International Journal of Quantum Chemistry 2017, 117. doi:10.1002/qua.25359
Other Beilstein-Institut Open Science Activities