Publications
Journal Article (7)
1.
Journal Article
61 (2), pp. 938 - 949 (2021)
Using open data to rapidly benchmark biomolecular simulations: phospholipid conformational dynamics. Journal of Chemical Information and Modeling 2.
Journal Article
154 (9), 094115 (2021)
Particle–particle particle–mesh algorithm for electrolytes between charged dielectric interfaces. The Journal of Chemical Physics 3.
Journal Article
21 (8), 2794 (2020)
Similar yet different–structural and functional diversity among Arabidopsis thaliana LEA_4 proteins. International Journal of Molecular Sciences 4.
Journal Article
8, 5 (2020)
A circuit topology approach to categorizing changes in biomolecular structure. Frontiers in Physics 5.
Journal Article
53 (8), pp. 2983 - 2990 (2020)
Structure of polyelectrolyte brushes on polarizable substrates. Macromolecules 6.
Journal Article
123 (43), pp. 9066 - 9079 (2019)
Headgroup Structure and Cation Binding in Phosphatidylserine Lipid Bilayers. The Journal of Physical Chemistry B 7.
Journal Article
117 (21), pp. 3076 - 3087 (2019)
Beyond direct simulation Monte Carlo (DSMC) modelling of collision environments. Molecular Physics Book Chapter (1)
8.
Book Chapter
30, pp. 1 - 38 (2019)
Refined molecular dynamics simulations of phospholipid bilayers. In: Advances in Biomembranes and Lipid Self-Assembly, Vol. Meeting Abstract (3)
9.
Meeting Abstract
118 (3, Supplement 1), pp. 141a - 142a. Cell Press, Cambridge, Mass. (2020)
Data-driven development of lipid force fields for molecular dynamics simulations. In Biophysical Journal, 10.
Meeting Abstract
118 (3, Supplement 1). Cell Press, Cambridge, Mass. (2020)
Spontaneous curvature generation in asymmetric lipid bilayers with tensionless leaflets. In Biophysical Journal, 11.
Meeting Abstract
118 (3, Supplement 1), p. 89a. Cell Press, Cambridge, Mass. (2020)
Formally correct solutions to local stress equation can be non-physical. In Biophysical Journal, Working Paper (1)
12.
Working Paper
Quasi-uncoupled rotational diffusion of phospholipid headgroups from the main molecular frame. arxiv Condensed Matter: Materials Science, 2009.06774 (2020)