Dr. Sigbjørn Løland Bore

	Postdoctoral Associate @ Paesani Group University 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 Curriculum Vitae		Tweets by SigbjornBore

Publications and manuscripts:

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]

Phase diagram of the TIP4P/Ice water model by enhanced sampling simulations
SLB, P.M. Piaggi, R. Car, F. Paesani
Under review (2022) [ChemRxiv]

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]

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]

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]

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]

Hamiltonian and Alias-Free Hybrid Particle-Field Molecular Dynamics
SLB, M. Cascella
J. Chem. Phys. 153, 094106 (2020) [arXiv]

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]

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)

Automated Determination of Hybrid Particle-Field Parameters by Machine Learning
M. Ledum, SLB, M. Cascella
Mol. Phys. 118, e1785571 (2020) [arXiv] [Presentation]

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]

High-Resolution Large Time-Step Schemes for Inviscid Fluid Flow
SLB, T. Flåtten
Appl. Math. Model. 81, 263-278 (2020)

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]

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]

Hybrid Particle-Field Model for Conformational Dynamics of Peptide Chains
SLB, G. Milano, M. Cascella
J. Chem. Theory Comput. 14, 1120-1130 (2018)

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]

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]

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

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)