Bore SL - Search Results

1

Dispersion state phase diagram of citrate-coated metallic nanoparticles in saline solutions.

Franco-Ulloa S, Tatulli G, Bore SL, Moglianetti M, Pompa PP, Cascella M, De Vivo M. Franco-Ulloa S, et al. Among authors: bore sl. Nat Commun. 2020 Oct 27;11(1):5422. doi: 10.1038/s41467-020-19164-3. Nat Commun. 2020. PMID: 33110063 Free PMC article.

2

A "short blanket" dilemma for a state-of-the-art neural network potential for water: Reproducing experimental properties or the physics of the underlying many-body interactions?

Zhai Y, Caruso A, Bore SL, Luo Z, Paesani F. Zhai Y, et al. Among authors: bore sl. J Chem Phys. 2023 Feb 28;158(8):084111. doi: 10.1063/5.0142843. J Chem Phys. 2023. PMID: 36859071

3

Hybrid Particle-Field Model for Conformational Dynamics of Peptide Chains.

Bore SL, Milano G, Cascella M. Bore SL, et al. J Chem Theory Comput. 2018 Feb 13;14(2):1120-1130. doi: 10.1021/acs.jctc.7b01160. Epub 2018 Jan 29. J Chem Theory Comput. 2018. PMID: 29316396

4

Hybrid Particle-Field Molecular Dynamics Simulations of Charged Amphiphiles in an Aqueous Environment.

Kolli HB, de Nicola A, Bore SL, Schäfer K, Diezemann G, Gauss J, Kawakatsu T, Lu ZY, Zhu YL, Milano G, Cascella M. Kolli HB, et al. Among authors: bore sl. J Chem Theory Comput. 2018 Sep 11;14(9):4928-4937. doi: 10.1021/acs.jctc.8b00466. Epub 2018 Aug 7. J Chem Theory Comput. 2018. PMID: 30037230

5

Mesoscale Electrostatics Driving Particle Dynamics in Nonhomogeneous Dielectrics.

Bore SL, Kolli HB, Kawakatsu T, Milano G, Cascella M. Bore SL, et al. J Chem Theory Comput. 2019 Mar 12;15(3):2033-2041. doi: 10.1021/acs.jctc.8b01201. Epub 2019 Feb 15. J Chem Theory Comput. 2019. PMID: 30694666

6

Aggregation of Lipid A Variants: A Hybrid Particle-Field Model.

De Nicola A, Soares TA, Santos DES, Bore SL, Sevink GJA, Cascella M, Milano G. De Nicola A, et al. Among authors: bore sl. Biochim Biophys Acta Gen Subj. 2021 Apr;1865(4):129570. doi: 10.1016/j.bbagen.2020.129570. Epub 2020 Feb 24. Biochim Biophys Acta Gen Subj. 2021. PMID: 32105775

7

Hybrid particle-field molecular dynamics under constant pressure.

Bore SL, Kolli HB, De Nicola A, Byshkin M, Kawakatsu T, Milano G, Cascella M. Bore SL, et al. J Chem Phys. 2020 May 14;152(18):184908. doi: 10.1063/5.0007445. J Chem Phys. 2020. PMID: 32414244

8

Supramolecular Packing Drives Morphological Transitions of Charged Surfactant Micelles.

Schäfer K, Kolli HB, Killingmoe Christensen M, Bore SL, Diezemann G, Gauss J, Milano G, Lund R, Cascella M. Schäfer K, et al. Among authors: bore sl. Angew Chem Int Ed Engl. 2020 Oct 12;59(42):18591-18598. doi: 10.1002/anie.202004522. Epub 2020 Aug 17. Angew Chem Int Ed Engl. 2020. PMID: 32543728 Free PMC article.

9

Can Polarity-Inverted Surfactants Self-Assemble in Nonpolar Solvents?

Carrer M, Škrbić T, Bore SL, Milano G, Cascella M, Giacometti A. Carrer M, et al. Among authors: bore sl. J Phys Chem B. 2020 Jul 23;124(29):6448-6458. doi: 10.1021/acs.jpcb.0c04842. Epub 2020 Jul 14. J Phys Chem B. 2020. PMID: 32618191 Free PMC article.

10

Hamiltonian and alias-free hybrid particle-field molecular dynamics.

Bore SL, Cascella M. Bore SL, et al. J Chem Phys. 2020 Sep 7;153(9):094106. doi: 10.1063/5.0020733. J Chem Phys. 2020. PMID: 32891104

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