Bartocci Alessio

A millisecond coarse-grained simulation approach to decipher allosteric cannabinoid binding at the glycine receptor α1 / A. Bartocci, A. Grazzi, N. Awad, P. Corringer, P.C.T. Souza, M. Cecchini. - In: NATURE COMMUNICATIONS. - ISSN 2041-1723. - 15:1(2024 Oct 19), pp. 9040.1-9040.10. [10.1038/s41467-024-53098-4]

A computational study to assess the pathogenicity of single or combinations of missense variants on respiratory complex I / L. Rigobello, F. Lugli, L. Caporali, A. Bartocci, J. Fadanni, F. Zerbetto, L. Iommarini, V. Carelli, A.M. Ghelli, F. Musiani. - In: INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES. - ISSN 0141-8130. - 273:Pt 2(2024 Jul), pp. 133086.1-133086.15. [10.1016/j.ijbiomac.2024.133086]

One touch is all it takes: the supramolecular interaction between ubiquitin and lanthanide complexes revisited by paramagnetic NMR and molecular dynamics / K. Dos Santos, A. Bartocci, N. Gillet, S. Denis-Quanquin, A. Roux, E. Lin, Z. Xu, R. Finizola, P. Chedozeau, X. Chen, C. Caradeuc, M. Baudin, G. Bertho, F. Riobe, O. Maury, E. Dumont, N. Giraud. - In: PHYSICAL CHEMISTRY CHEMICAL PHYSICS. - ISSN 1463-9076. - 26:20(2024 May 22), pp. 14573-14581. [10.1039/d4cp00463a]

Situating the phosphonated calixarene-cytochrome C association by molecular dynamics simulations / A. Bartocci, E. Dumont. - In: JOURNAL OF CHEMICAL PHYSICS ONLINE. - ISSN 1089-7690. - 160:10(2024), pp. 105101.1-105101.12. [10.1063/5.0198522]

Probing the dynamical interaction of the para-sulfonato-calix[4]arene with an antifungal protein / A. Bartocci, E. Dumont. - In: PHYSICAL CHEMISTRY CHEMICAL PHYSICS. - ISSN 1463-9076. - 25:27(2023 Jul 12), pp. 18067-18074. [10.1039/d3cp01202f]