Computational biophysics meets cryo‐EM revolution in the search for the functional dynamics of biomolecular systems - Costa - 2024 - WIREs Computational Molecular Science - Wiley Online Library

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Efficient Flexible Fitting Refinement with Automatic Error Fixing for De Novo Structure Modeling from Cryo-EM Density Maps

WIREs Computational Molecular Science - Wiley Online Library

CHARMM-GUI MDFF/xMDFF Utilizer for Molecular Dynamics Flexible Fitting Simulations in Various Environments

A New Strategy for Atomic Flexible Fitting in Cryo-EM Maps by Molecular Dynamics with Excited Normal Modes (MDeNM-EMfit)

Computational biophysics meets cryo‐EM revolution in the search for the functional dynamics of biomolecular systems - Costa - 2024 - WIREs Computational Molecular Science - Wiley Online Library

Integrative Structural Biology

Relative Affinities of Protein–Cholesterol Interactions from Equilibrium Molecular Dynamics Simulations

Computational biophysics meets cryo‐EM revolution in the search for the functional dynamics of biomolecular systems - Costa - 2024 - WIREs Computational Molecular Science - Wiley Online Library

Frontiers Simulation and Machine Learning Methods for Ion-Channel Structure Determination, Mechanistic Studies and Drug Design

IJMS, Free Full-Text

Computational Analysis Enables Breakthrough in Biomolecular Dynamics

Frontiers Editorial: Recent advances in computational modelling of biomolecular complexes