Why a diaminopyrrolic tripodal receptor binds mannosides in acetonitrile but not in water?

Diogo Vila-Viçosa, Oscar Francesconi and Miguel Machuqueiro
Beilstein J. Org. Chem. 2014, 10, 1513–1523. https://doi.org/10.3762/bjoc.10.156

Supporting Information

Supporting Information File 1: Diagrams with the population of each microstate, histograms of Rg, free energy profiles and schematic representation of the position of the arms at all pH values.
Format: PDF Size: 2.6 MB Download

Cite the Following Article

Why a diaminopyrrolic tripodal receptor binds mannosides in acetonitrile but not in water?
Diogo Vila-Viçosa, Oscar Francesconi and Miguel Machuqueiro
Beilstein J. Org. Chem. 2014, 10, 1513–1523. https://doi.org/10.3762/bjoc.10.156

How to Cite

Vila-Viçosa, D.; Francesconi, O.; Machuqueiro, M. Beilstein J. Org. Chem. 2014, 10, 1513–1523. doi:10.3762/bjoc.10.156

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.

Citations to This Article

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

Scholarly Works

  • Francesconi, O.; Roelens, S. Biomimetic Carbohydrate-Binding Agents (CBAs): Binding Affinities and Biological Activities. Chembiochem : a European journal of chemical biology 2019, 20, 1329–1346. doi:10.1002/cbic.201800742
  • Silva, T.; Vila-Viçosa, D.; Reis, P. B. P. S.; Victor, B. L.; Diem, M.; Oostenbrink, C.; Machuqueiro, M. The Impact of Using Single Atomistic Long-Range Cutoff Schemes with the GROMOS 54A7 Force Field. Journal of chemical theory and computation 2018, 14, 5823–5833. doi:10.1021/acs.jctc.8b00758
  • Reis, P. B. P. S.; Vila-Viçosa, D.; Campos, S. R. R.; Baptista, A. M.; Machuqueiro, M. Role of Counterions in Constant-pH Molecular Dynamics Simulations of PAMAM Dendrimers. ACS omega 2018, 3, 2001–2009. doi:10.1021/acsomega.7b01708
  • Santos, H. A.; Vila-Viçosa, D.; Teixeira, V. H.; Baptista, A. M.; Machuqueiro, M. Constant-pH MD Simulations of DMPA/DMPC Lipid Bilayers. Journal of chemical theory and computation 2015, 11, 5973–5979. doi:10.1021/acs.jctc.5b00956
  • Magalhães, P. R.; Machuqueiro, M.; Baptista, A. M. Constant-pH Molecular Dynamics Study of Kyotorphin in an Explicit Bilayer. Biophysical journal 2015, 108, 2282–2290. doi:10.1016/j.bpj.2015.03.052
  • Vila-Viçosa, D.; Teixeira, V. H.; Baptista, A. M.; Machuqueiro, M. Constant-pH MD Simulations of an Oleic Acid Bilayer. Journal of chemical theory and computation 2015, 11, 2367–2376. doi:10.1021/acs.jctc.5b00095
Other Beilstein-Institut Open Science Activities