Structure and dynamics of a multidomain ligand-gated ion channel revealed under acidic conditions

Using cryogenic electron microscopy under acidic conditions, researchers determined the structure of the bacterial ligand-gated ion channel DeCLIC in a previously unreported expanded-pore conformation, identifying it as a functional open state and elucidating how calcium binding and N-terminal domain dynamics drive channel closure.

Anden, O., Rovsnik, U., Lycksell, M. + 3 more2026-04-01⚛️ biophysics

How Well Do Molecular Dynamics Force Fields Model Peptides? A Systematic Benchmark Across Diverse Folding Behaviors

This study benchmarks twelve fixed-charge force fields across a diverse set of twelve peptides to evaluate their ability to model structural plasticity and folding behaviors, revealing that while no single model is universally optimal, the results provide critical insights into current limitations and practical guidance for peptide simulations.

Singh, B., Martinez-Noa, Y., perez, a.2026-04-01⚛️ biophysics

Mass photometry reveals stoichiometry and binding dynamics of bispecific tetravalent anti-VEGF-PD-1 antibody ivonescimab

Using mass photometry and kinetic modeling, this study characterizes the binding dynamics of the bispecific antibody ivonescimab, revealing that it predominantly forms stable 2:2 dimers with VEGF and ternary complexes presenting two PD-1 molecules, with distinct dissociation constants for each interaction.

Jajcanin Jozic, N., Bishop, J., O'Shea, A. R. + 3 more2026-04-01⚛️ biophysics

Intermittent attachments form three-dimensional cell aggregates with emergent fluid properties

This paper presents a minimal cell-based model demonstrating that active intermittent attachments drive the transition of cell populations into three-dimensional aggregates with emergent fluid-like properties, successfully explaining experimental observations of cancer cell dewetting, shape fluctuations, and collective chemotaxis.

Panigrahi, D. P., Celora, G. L., Ford, H. Z. + 4 more2026-04-01⚛️ biophysics

How Well Can AI and Physics-Based Simulations Predict the Probability a Cryptic Pocket Is Open?

This study benchmarks AI-based ensemble predictors and physics-based molecular dynamics simulations against experimental data for cryptic pockets in Ebola VP35 and TEM β\beta-lactamase, revealing that while these methods can successfully predict the relative impact of mutations on pocket opening, they currently fail to reliably predict absolute opening probabilities, particularly for rare states with less than 1% occupancy.

Zhang, S., Miller, J. J., Bowman, G. R.2026-04-01⚛️ biophysics

Closed Kinematic Chain Biomechanics and Cycling: Linking Biomechanical Variables to Knee Joint Loading

This study utilized OpenSim inverse dynamics and static optimization on data from 16 cyclists to characterize substantial inter-subject variability in knee joint moments and reaction forces, highlighting the critical roles of specific muscle groups and supporting the need for personalized training and rehabilitation strategies in cycling.

BAHO VITA, H., Welegebriel, D. F.2026-04-01⚛️ biophysics