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Nucleic Acids Research|May 1, 2016
Protein Frustratometer 2: a tool to localize energetic frustration in protein molecules, now with electrostaticsR Gonzalo Parra, Nicholas P Schafer, Leandro G Radusky, et al.Biophysical Journal|February 25, 2016
Binding of NFκB Appears to Twist the Ankyrin Repeat Domain of IκBαMorten Beck Trelle, Kristen M Ramsey, Taehyung C Lee, et al.Journal of Chemical Theory and Computation|May 13, 2020
Protein Structure Prediction in CASP13 Using AWSEM-SuiteShikai Jin, Mingchen Chen, Xun Chen, et al.Journal of Molecular Biology|November 22, 2025
Cracking Controls ATP Hydrolysis in the Catalytic Unit of a P-type ATPaseM Agueda Placenti, Santiago A Martinez-Gache, Rodolfo M González-Lebrero, et al.Nature Communications|August 11, 2025
DNA polymerase actively and sequentially displaces single-stranded DNA-binding proteinsLongfu Xu, Shikai Jin, Mia Urem, et al.Science Advances|December 20, 2024
Trapped-ion quantum simulation of electron transfer models with tunable dissipationVisal So, Midhuna Duraisamy Suganthi, Abhishek Menon, et al.Nature Communications|February 5, 2024
DynamicBind: predicting ligand-specific protein-ligand complex structure with a deep equivariant generative modelWei Lu, Jixian Zhang, Weifeng Huang, et al.Proceedings of the National Academy of Sciences of the United States of America|September 14, 2021
Frustrated peptide chains at the fibril tip control the kinetics of growth of amyloid-β fibrilsYuechuan Xu, Kaitlin Knapp, Kyle N Le, et al.Biophysical Journal|December 28, 2020
Frustration and Direct-Coupling Analyses to Predict Formation and Function of Adeno-Associated VirusNicole N Thadani, Qin Zhou, Kiara Reyes Gamas, et al.QRB Discovery|August 2, 2023
Resolving the fine structure in the energy landscapes of repeat proteinsMurilo N Sanches, R Gonzalo Parra, Rafael G Viegas, et al.Pageof 23