39 citations · 59 across the 4 of their papers we have counts for
4 papers
Efficient generation of random rotation matrices in four dimensions
Jakob Tómas Bullerjahn, Balázs Fábián, Gerhard Hummer
Markov-chain Monte Carlo algorithms rely on trial moves that are either rejected or accepted based on certain criteria. Here, we provide an efficient algorithm to generate random r…
Small ionic radii limit time step in Martini 3 molecular dynamics simulations
Balázs Fábián, Sebastian Thallmair, Gerhard Hummer
Among other improvements, the Martini 3 coarse-grained force field provides a more accurate description of the solvation of protein pockets and channels through the consistent use…
Comment on "Capturing Phase Behavior of Ternary Lipid Mixtures with a Refined Martini Coarse-Grained Force Field"
Matti Javanainen, Balazs Fabian, Hector Martinez-Seara
We report here on the pitfalls of the simulation model introduced in the "Capturing Phase Behavior of Ternary Lipid Mixtures with a Refined Martini Coarse-Grained Force Field" [Jou…
Pressure Profile Calculation with Mesh Ewald Methods
Marcello Sega, Balázs Fábián, Pál Jedlovszky
The importance of calculating pressure profiles across liquid interfaces is increasingly gaining recognition, and efficient methods for the calculation of long-range contributions…