Jussupow, Alexander

Effective Molecular Dynamics from Neural-Network Based Structure Prediction Models

Jussupow, A., & Kaila, V. R. I. (2022) · Journal of Chemical Theory and Computation

Protein Structure and DynamicsComputational Drug Discovery Methods

Cited by 42

Effective Molecular Dynamics from Neural Network-Based Structure Prediction Models

Jussupow, A., & Kaila, V. R. I. (2023) · Journal of Chemical Theory and Computation

Protein Structure and DynamicsComputational Drug Discovery Methods

Cited by 42

Molecular Modeling and Molecular Dynamics Simulation of a Packed and Intact Bacterial Microcompartment

Raza, S., Yadav, N. S., Jussupow, A., Kerfeld, C. A., Feig, M., & Vermaas, J. V. (2025) · The Journal of Physical Chemistry B

Protein Structure and DynamicsAdvanced Physical and Chemical Molecular Interactions

Cited by 4

Structure Characterization of Bacterial Microcompartment Shells via X-ray Scattering and Coordinate Modeling: Evidence for adventitious capture of cytoplasmic proteins

Zuo, X., Jussupow, A., Ponomarenko, N. S., Tefft, N. M., Yadav, N. S., Range, K. L., Ralston, C. Y., TerAvest, M. A., Sutter, M., Kerfeld, C. A., et al. (2024) · ACS Applied Bio Materials

Enzyme Structure and FunctionProtein Structure and Dynamics

Cited by 3