Author

H. Grubmuller

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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Research Focus:protein folding & dynamics· 3 Approach:statistical model· 3 Approach:biophysical modeling· 2 Research Focus:benchmarking· 1 Approach:deep learning· 1 Research Focus:drug response / drug discovery· 1 Approach:experimental assay· 1 Organism:human· 1

Frequent Co-Authors

G. Nagy· 2 shared L. V. Bock· 2 shared B. Farkas· 1 shared B. Kiss· 1 shared G. Bubnis· 1 shared G. Lukacs· 1 shared H. Tordai· 1 shared J. Kunkel· 1 shared

Activity by Year

2019-2021 · peak 2/yr

Co-Author Collaboration Network

10 top collaborators · 13 mutual co-author links

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2 shared papersBiophysics

G. Nagy

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5 papers

Recent·Most cited

Nanomechanics combined with HDX reveal allosteric drug binding sites of CFTR NBD1

R. Padanyi, B. Farkas, H. Tordai, B. Kiss, H. Grubmuller, N. Soya, G. Lukacs, M. Kellermayer, T. Hegedus

This study combines nanomechanics and HDX to identify allosteric binding sites in {Delta}F508-CFTR NBD1, revealing how BIA stabilizes the protein.

bioRxiv · Aug 20, 2021Biophysics

Folding of VemP into translation-arresting secondary structure is driven by the ribosome exit tunnel

M. H. Kolar, G. Nagy, J. Kunkel, S. M. Vaiana, L. V. Bock, H. Grubmuller

The paper investigates how the ribosome exit tunnel drives the formation of a helical structure in the peptide VemP, leading to translational arrest.

bioRxiv · Apr 15, 2021Biophysics

Sequential water and headgroup merger: Membrane poration paths and energetics from MD simulations

G. Bubnis, H. Grubmuller

This study uses MD simulations to uncover the nucleation mechanism and energetics of lipid membrane pores, identifying an indentation pathway and water column dynamics as key features.

bioRxiv · Jun 15, 2020Biophysics

tRNA dissociation from EF-Tu after GTP hydrolysis and Pi release: primary steps and antibiotic inhibition

M. Warias, H. Grubmuller, L. V. Bock

The paper uses molecular dynamics simulations to study tRNA release from EF-Tu after GTP hydrolysis and how kirromycin inhibits this process by blocking domain closure.

bioRxiv · Apr 11, 2019Biophysics

SESCA: Predicting Circular Dichroism Spectra from Protein Molecular Structures

G. Nagy, M. Igaev, S. V. Hoffmann, N. C. Jones, H. Grubmuller

SESCA predicts circular dichroism spectra from protein structures, outperforming existing methods with 50% smaller average deviation.

bioRxiv · Feb 25, 2019Biophysics