Abhishek Singharoy

Asst Professor

  • 568 Citations
  • 13 h-Index
20072019
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Fingerprint Fingerprint is based on mining the text of the experts' scientific documents to create an index of weighted terms, which defines the key subjects of each individual researcher.

Molecular Dynamics Simulation Medicine & Life Sciences
Molecular dynamics Chemical Compounds
Nanosystems Chemical Compounds
Atoms Chemical Compounds
Cryoelectron Microscopy Medicine & Life Sciences
Viruses Chemical Compounds
simulation Physics & Astronomy
Electron microscopy Chemical Compounds

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Research Output 2007 2018

  • 568 Citations
  • 13 h-Index
  • 32 Article
  • 1 Chapter
2 Citations (Scopus)

Constructing atomic structural models into cryo-EM densities using molecular dynamics – Pros and cons

Wang, Y., Shekhar, M., Thifault, D., Williams, C. J., McGreevy, R., Richardson, J., Singharoy, A. & Tajkhorshid, E., Jan 1 2018, (Accepted/In press) In : Journal of Structural Biology.

Research output: Contribution to journalArticle

Structural Models
Molecular Dynamics Simulation
Galactosidases
Electrons
Research
1 Citation (Scopus)

Inchworm movement of two rings switching onto a thread by biased Brownian diffusion represent a three-body problem

Benson, C. R., Maffeo, C., Fatila, E. M., Liu, Y., Sheetz, E. G., Aksimentiev, A., Singharoy, A. & Flood, A. H., Sep 18 2018, In : Proceedings of the National Academy of Sciences of the United States of America. 115, 38, p. 9391-9396 6 p.

Research output: Contribution to journalArticle

Rotaxanes
Electrochemistry
Fourier Analysis
Thermodynamics
3 Citations (Scopus)

CHARMM-GUI MDFF/xMDFF Utilizer for Molecular Dynamics Flexible Fitting Simulations in Various Environments

Qi, Y., Lee, J., Singharoy, A., McGreevy, R., Schulten, K. & Im, W., Apr 20 2017, In : Journal of Physical Chemistry B. 121, 15, p. 3718-3723 6 p.

Research output: Contribution to journalArticle

graphical user interface
Molecular Dynamics Simulation
Vacuum
Graphical user interfaces
Molecular dynamics
13 Citations (Scopus)

Chemomechanical coupling in hexameric protein-protein interfaces harnesses energy within V-type ATPases

Singharoy, A., Chipot, C., Moradi, M. & Schulten, K., Jan 11 2017, In : Journal of the American Chemical Society. 139, 1, p. 293-310 18 p.

Research output: Contribution to journalArticle

Vacuolar Proton-Translocating ATPases
Adenosinetriphosphate
Adenosine Triphosphate
Proteins
Hydrolysis
4 Citations (Scopus)

Methodology for the Simulation of Molecular Motors at Different Scales

Singharoy, A. & Chipot, C., Apr 20 2017, In : Journal of Physical Chemistry B. 121, 15, p. 3502-3514 13 p.

Research output: Contribution to journalArticle

Molecular dynamics
Molecular Motor Proteins
methodology
Molecular Dynamics Simulation
Vacuolar Proton-Translocating ATPases

Projects 2018 2019