scholarly journals In Silico Mutation and Binding Studies of Human FVIIa γ-Carboxyglutamic Acid-Domain to Endothelial Protein C Receptor: A Molecular Dynamics Simulation Approach

ACS Omega ◽  
2019 ◽  
Vol 4 (1) ◽  
pp. 496-508
Author(s):  
Suparna Banerjee ◽  
Ramesh Prasad ◽  
Prosenjit Sen
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
In Silico ◽  
Protein C ◽  
Dynamics Simulation ◽  
Simulation Approach ◽  
Endothelial Protein C Receptor ◽  
Binding Studies ◽  
Carboxyglutamic Acid ◽  
Acid Domain

scholarly journals In silico assessment of human Calprotectin subunits (S100A8/A9) in presence of sodium and calcium ions using Molecular Dynamics simulation approach

PLoS ONE ◽  
2019 ◽  
Vol 14 (10) ◽  
pp. e0224095 ◽  
Author(s):  
Nematollah Gheibi ◽  
Mohammad Ghorbani ◽  
Hanifeh Shariatifar ◽  
Alireza Farasat
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Calcium Ions ◽  
In Silico ◽  
Dynamics Simulation ◽  
Simulation Approach

In Silico Characterization of B Cell and T Cell Epitopes for Subunit Vaccine Design ofSalmonella typhiPgtE: A Molecular Dynamics Simulation Approach

2019 ◽  
Vol 26 (2) ◽  
pp. 105-116 ◽  
Author(s):  
Gopinath Samykannu ◽  
Princy Vijayababu ◽  
Christian Bharathi Antonyraj ◽  
Perumal Perumal ◽  
Sundarabaalaji Narayanan ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
B Cell ◽  
In Silico ◽  
Subunit Vaccine ◽  
Dynamics Simulation ◽  
T Cell Epitopes ◽  
Simulation Approach ◽  
In Silico Characterization

Rational Design and Engineering of a Mutant Variant of Urate Oxidase as a Therapeutic Enzyme: A Molecular Dynamics Simulation Approach

2017 ◽  
Vol 13 (1) ◽  
pp. 30-38
Author(s):  
Sajjad Ahrari ◽  
Fatemeh Dabbagh ◽  
Sobhan Ahrari ◽  
Younes Ghasemi ◽  
Navid Mogharrab ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Rational Design ◽  
Dynamics Simulation ◽  
Urate Oxidase ◽  
Simulation Approach ◽  
Mutant Variant

scholarly journals Distribution and Transport of CO2 in Hydrated Hyperbranched Poly(ethylenimine) Membranes: A Molecular Dynamics Simulation Approach

ACS Omega ◽  
2021 ◽  
Vol 6 (4) ◽  
pp. 3390-3398
Author(s):  
Kyung Il Kim ◽  
Robin Lawler ◽  
Hyun June Moon ◽  
Pavithra Narayanan ◽  
Miles A. Sakwa-Novak ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation ◽  
Simulation Approach ◽  
Hyperbranched Poly
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