Sunita Negi

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Publications (15)

• Charge calculation studies done on an end-functionalized double-walled carbon nanotube using MOPAC
  Indian Journal of Physics 2020 DOI: 10.1007/s12648-019-01473-z
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• Molecular dynamics simulations to study the interaction between carbon nanotube and calmodulin protein
  Materials Today: Proceedings 2020 DOI: 10.1016/j.matpr.2020.01.354
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• End functionalization of a double walled carbon nanotube for biomedical application
  AIP Conference Proceedings 2019 DOI: 10.1063/1.5097107
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• Charge calculation studies done on a single walled carbon nanotube using MOPAC
  Indian Journal of Physics 2018 DOI: 10.1007/s12648-017-1127-7
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• Extraction of RBM frequency of a (10, 0) SWNT using MATLAB
  AIP Conference Proceedings 2018 DOI: 10.1063/1.5032335
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• Simulation studies of nanomotors based on carbon nanotubes for nanodelivery systems
  Recent Trends in Nanomedicine and Tissue Engineering 2017
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• Role of salt bridge formation in the conformation change of proteins
  2016 4th International Conference on Parallel, Distributed and Grid Computing, PDGC 2016 2016 DOI: 10.1109/PDGC.2016.7913136
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• Temperature dependent conformation studies of Calmodulin Protein using Molecular Dynamics
  Journal of Physics: Conference Series 2016 DOI: 10.1088/1742-6596/759/1/012022
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• Effect of calcium ion removal, ionic strength, and temperature on the conformation change in calmodulin protein at physiological ph
  Journal of Biophysics 2014 DOI: 10.1155/2014/329703
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• Calmodulin readily switches conformation upon protonating high p K <inf>a</inf> acidic residues
  Journal of Physical Chemistry B 2012 DOI: 10.1021/jp3032995
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