This important study characterizes the mechanics and stability of bolalipids from archaeal membranes using molecular dynamics simulations. A mesoscale model of bolalipids is presented and evaluated ...

Coarse-grained models are computational models that mimic the behaviour of a complex system by breaking it down into simpler sub-components. The extent to which the system is broken down reflects ...

Wholesale coarse rice prices drop Tk2-3 per kg in a week Retail prices, including fine varieties, remain largely elevated Prices in Chattogram drop Tk3-4 per kg for coarse varieties In Naogaon, a rice ...

Laboratory of Multiscale Modeling of Molecular Systems, G.A. Krestov Institute of Solution Chemistry of the Russian Academy of Sciences, 1 Akademicheskaya St., 153045 Ivanovo, Russian Federation ...

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Reviewer #1 (Public review): Summary: The manuscript investigates lipid scrambling mechanisms across TMEM16 family members using coarse-grained molecular dynamics (MD) simulations. While the study ...

The goal is to sample the path ensemble (PE) segments internal to A─dynamics of the bound dimer ... This rapid exchange is primarily due to the smoother free energy surface in coarse-grained Martini 3 ...

With just a few lines of mBuild code, you can assemble reusable components into complex molecular systems for molecular dynamics simulations. mBuild is designed to minimize or even eliminate the need ...