Dr. Sigbjørn Løland Bore

	Postdoctoral Associate @ Paesani Group University of California, San Diego Department of Chemistry and Biochemsitry 9500 Gilman Dr. La Jolla CA 92093 Telephone number (NO): (+47) 928 81 237 Telephone number (US): (+1) (858)-346-3054 University E-mail: sbore(at)ucsd.edu Personal E-mail: Sigbjorn.Loland.Bore(at)gmail.com 0000-0002-8620-4885 Google scholar Follow @SigbjornBore		Tweets by SigbjornBore

Publications and manuscripts:

1. A “short blanket” dilemma for a state-of-the-art neural network potential for water: Reproducing properties or learning the underlying physics?
   Y. Zhai, A. Caruso, SLB, F. Paesani
   Under review (2022) [ChemRxiv]
2. Data-Driven Many-Body Potential Energy Functions for Generic Molecules: Linear Alkanes as a Proof-of-Concept Application
   E.F. Bull-Vulpe, M. Riera, SLB, F. Paesani
   Under review (2022) [ChemRxiv]
3. Phase diagram of the TIP4P/Ice water model by enhanced sampling simulations
   SLB, P.M. Piaggi, R. Car, F. Paesani
   J. Chem. Phys 157, 054504 (2022) [ChemRxiv]
4. HylleraasMD: Massively parallel hybrid particle-field molecular dynamics in Python
   M. Ledum, S. Sen, X. Li, M. Carrer, M. Cascella, SLB
   Under review (2022) [PDF]
5. HylleraasMD: A Domain Decomposition-Based Hybrid Particle-Field Software for Multi-Scale Simulations of Soft Matter
   M. Ledum, S. Sen, X. Li, M. Carrer, Yu Feng, M. Cascella, SLB
   Under review (2022) [ChemRxiv]
6. Aggregation of Lipid A Variants: a Hybrid Particle-Field Model
   A. De Nicola, T.A. Soares, D.E.S. Santos, SLB, G.J.A. Sevink, M. Cascella, G. Milano
   Biochim. Biophys. Acta 1865, 129570 (2021) [ChemRxiv]
7. Dispersion state phase diagram of citrate-coated metallic nanoparticles in saline solutions
   S. Franco-Ulloa, G. Tatulli, SLB, M. Moglianetti, P. Pompa, M. Cascella, M. De Vivo
   Nat. Commun. 11, 5422 (2020) [ChemRxiv]
8. Hamiltonian and Alias-Free Hybrid Particle-Field Molecular Dynamics
   SLB, M. Cascella
   J. Chem. Phys. 153, 094106 (2020) [arXiv]
9. Can polarity-inverted surfactants self-assemble in nonpolar solvents?
   M. Carrer, T. Skrbic, SLB, G. Milano, M. Cascella, A. Giacometti
   J. Phys. Chem. B 124, 6448-6458 (2020) [ChemRxiv]
10. Supramolecular Packing Drives Morphological Transition of Charged Surfactant Micelles
    K. Schäfer, H.B. Kolli, M.K. Christensen, SLB, G. Diezemann, J. Gauss, G. Milano, R. Lund, M. Cascella
    Angew. Chem. 59, 2-10 (2020)

11. Automated Determination of Hybrid Particle-Field Parameters by Machine Learning
    M. Ledum, SLB, M. Cascella
    Mol. Phys. 118, e1785571 (2020) [arXiv] [Presentation]
12. Hybrid Particle-Field Molecular Dynamics Under Constant Pressure
    SLB, H.B. Kolli, A. De Nicola, M. Byshkin, T. Kawakatsu, G. Milano, M. Cascella
    J. Chem. Phys. 152, 184908 (2020) [arXiv]
13. High-Resolution Large Time-Step Schemes for Inviscid Fluid Flow
    SLB, T. Flåtten
    Appl. Math. Model. 81, 263-278 (2020)
14. Mesoscale electrostatics driving particle dynamics in non-homogeneous dielectrics
    SLB, H.B. Kolli, T. Kawakatsu, G. Milano, M. Cascella
    J. Chem. Theory Comput. 15, 2033 (2019) [ChemRxiv]
15. Hybrid Particle-Field Molecular Dynamics Simulations of Charged Amphiphiles in Aqueous Environment
    Hima Bindu Kolli, A. De Nicola, SLB, K. Schäfer, G. Diezemann, J. Gauss, T. Kawakatsu, Z. Lu, Y. Zhu, G. Milano, M. Cascella
    J. Chem. Theory Comput. 14, 4928-4937 (2018) [ChemRxiv]
16. Hybrid Particle-Field Model for Conformational Dynamics of Peptide Chains
    SLB, G. Milano, M. Cascella
    J. Chem. Theory Comput. 14, 1120-1130 (2018)
17. Coupling spin to velocity: collective motion of Hamiltonian polar particles
    SLB, M. Schindler, K.N. Thu Lam, E. Bertin, O. Dauchot
    J. Stat. Mech. 3, 033305 (2016) [arXiv]

Writings:

1. Snø i Japan [PDF] (Klassekampen, 2021)
2. Corona-problemet [PDF] (Klassekampen, 2020)
3. I anledning telefonkioskens dag [PDF] (Aftenbladet, 2020)
4. Den hellige treenigheten [PDF] [PDF-V2] (Klassekampen, 2019)
5. Hverdagshykleri [PDF] (Aftenbladet, 2018)
6. Øyblikket da du blir voksen [PDF] (Klassekampen, 2018)
7. Hund på bar [PDF] (Klassekampen, 2018)
8. Ukultur hos havets kardinaler [PDF] (Klassekampen, 2018)
9. Glem ikke å sette opp ølteltet (Universitas, 2017)
10. Make Frederikke greit again (Universitas, 2016)

Talks:

• Advances in the Hybrid Particle-Field Approach, University of Oslo, PhD lecture, Oslo, Norway (2020) [PDF]
• Principles of Monte Carlo Simulations, University of Oslo, PhD trial lecture, Oslo, Norway (2020) [PDF]
• Hybrid Particle-Field Molecular Dynamics Under Constant Pressure, Norwegian Chemical Society, Annual Meeting in Quantum and Computational Chemistry, Trondheim, Norway (2019) [ABSTRACT] [PDF]
• Hybrid particle-field molecular dynamics for biological systems, Hylleraas seminar, Oslo, Norway (2019) [PDF] [HANDOUT]
• Hybrid particle-field model for DNA, Hylleraas seminar, Oslo, Norway (2019) [PDF] [HANDOUT]
• Molecular dynamics in a density dependent inhomogeneous dielectric, NKS-meeting, Lillestrøm, Norway (2018) [PDF]
• Hybrid Particle-Field Model for Conformational Dynamics of Peptide Chains, CECAM-conference, Trento Italy (2018) [PDF]

Meeting and conference abstracts:

• Hybrid Particle-Field Molecular Dynamics Under Constant Pressure, NKS, Annual Meeting in Quantum and Computational Chemistry, Trondheim, Norway (2019) [PDF]

Review activity:

• Journal of Computational Physics (2019: 1)
• Journal of Chemical Theory and Computation (2020: 2)

Examiation assignments:

• Physical Chemistry I - Thermodynamics and Kinetics (KJM1130), written exam, University of Oslo (2016, 2017, 2018)
• Molecular Modelling (KJM5630), oral exam, University of Oslo (2017, 2018)

Other academic work:

PhD thesis

• Advances in the Hybrid Particle-Field Approach [PDF]

Master thesis

• High-Resolution Large Time-Step Schemes for Hyperbolic Conservation Laws [PDF]

Projects and reports

• Compendium in fluid mechanics by Iver Brevik (Norwegian)