Author

S. Sasmal

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Biophysics· 1

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Research Focus:benchmarking· 1 Approach:deep learning· 1 Research Focus:protein folding & dynamics· 1 Approach:statistical model· 1 Assay:structural biology· 1

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G. M. Hocky· 1 shared M. McCullagh· 1 shared T. Pal· 1 shared

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2024-2024 · peak 1/yr

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1 shared paperBiophysics

G. M. Hocky

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1 paper

Recent·Most cited

Quantifying Unbiased Conformational Ensembles from Biased Simulations Using ShapeGMM

S. Sasmal, T. Pal, G. M. Hocky, M. McCullagh

This paper introduces frame-weighted shapeGMM to quantify unbiased biomolecular conformational ensembles from biased simulations, showing improved accuracy in thermodynamic property calculations and structural transitions.

bioRxiv · Jan 22, 2024Biophysics