Author

D. S. Cerutti

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

Biology Disciplines

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Biophysics· 2

Signature Assays, Organisms & Methods

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Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Approach:mechanistic / dynamical model· 1 Research Focus:protein folding & dynamics· 1 Assay:protein structure· 1 Approach:statistical model· 1

Frequent Co-Authors

A. G. Rao· 1 shared C. Wiebeler· 1 shared I. Schapiro· 1 shared R. Wiewiora· 1 shared S. Boothroyd· 1 shared S. Sen· 1 shared W. Sherman· 1 shared

Activity by Year

2020-2024 · peak 1/yr

Co-Author Collaboration Network

7 top collaborators · 9 mutual co-author links

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1 shared paperBiophysics

A. G. Rao

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2 papers

Recent·Most cited

STORMM: Structure and TOpology Replica Molecular Mechanics for chemical simulations

D. S. Cerutti, S. Boothroyd, R. Wiewiora, W. Sherman

STORMM is a high-performance molecular simulation engine optimized for CPUs and GPUs, offering improved throughput and accuracy for small molecule and protein simulations.

bioRxiv · Mar 27, 2024 · PreprintBiophysics

Histidine Protonation Controls Structural Heterogeneity in the Cyanobacteriochrome AnPixJg2

A. G. Rao, C. Wiebeler, S. Sen, D. S. Cerutti, I. Schapiro

This study identifies histidine protonation as the cause of structural heterogeneity in the cyanobacteriochrome AnPixJg2, showing how it affects chromophore conformation and photoconversion yield.

bioRxiv · Aug 21, 2020Biophysics