Assembly of Protein Complexes In and On the Membrane with Predicted Spatial Arrangement Constraints

C Christoffer, K Harini, G Archit, D Kihara - Journal of Molecular Biology, 2024 - Elsevier
Membrane proteins play crucial roles in various cellular processes, and their interactions
with other proteins in and on the membrane are essential for their proper functioning. While …

Frontiers in integrative structural modeling of macromolecular assemblies

K Majila, S Arvindekar, M Jindal, S Viswanath - QRB Discovery, 2025 - cambridge.org
Integrative modeling enables structure determination for large macromolecular assemblies
by combining data from multiple experiments with theoretical and computational predictions …

Frontiers in integrative structural biology: modeling disordered proteins and utilizing in situ data

K Majila, S Arvindekar, M Jindal… - arXiv preprint arXiv …, 2024 - arxiv.org
Integrative modeling enables structure determination for large macromolecular assemblies
by combining data from multiple sources of experiment data with theoretical and …

A new discrete-geometry approach for integrative docking of proteins using chemical crosslinks

Y Zhang, M Jindal, S Viswanath, M Sitharam - bioRxiv, 2024 - biorxiv.org
The structures of protein complexes allow us to understand and modulate the biological
functions of the proteins. Integrative docking is a computational method to obtain the …

Predicting the alternative conformation of a known protein structure based on the distance map of AlphaFold2

J Li, Z Zhu, C Song - bioRxiv, 2024 - biorxiv.org
With AlphaFold2 (AF2) becoming the top structural prediction tool, multiple studies have
found that AF2 often favors one conformation state over others in high-precision structure …

Improving AlphaFold 3 structural modeling by incorporating explicit crosslinks

J Kosinski - bioRxiv, 2024 - biorxiv.org
AlphaFold 3 has significantly advanced the modeling of macromolecular structures,
including proteins, DNA, RNA, and their interactions with small molecules or post …