2020
DOI: 10.1007/s10904-020-01740-1
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A Molecular Dynamics Study Proposing the Existence of Structural Interaction Between Cancer Cell Receptor and RNA Aptamer

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Cited by 3 publications
(1 citation statement)
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“…The performed protocol of simulation for all systems was containing “minimization, annealing, and a final 50 ns and 100 ns NPT (isothermal–isobaric) ensemble production simulation”. 77,78 During the NPT production simulation, temperature and pressure were considered to be fixed using a Langevin thermostat 79 and barostat. 80 In the NPT production run, the Langevin piston target was set to 1 atm.…”
Section: Computational Detailsmentioning
confidence: 99%
“…The performed protocol of simulation for all systems was containing “minimization, annealing, and a final 50 ns and 100 ns NPT (isothermal–isobaric) ensemble production simulation”. 77,78 During the NPT production simulation, temperature and pressure were considered to be fixed using a Langevin thermostat 79 and barostat. 80 In the NPT production run, the Langevin piston target was set to 1 atm.…”
Section: Computational Detailsmentioning
confidence: 99%