Perturbation of ACE2 Structural Ensembles by SARS-CoV-2 Spike Protein Binding
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SciScore for 10.1101/2021.03.02.433608: (What is this?)
Please note, not all rigor criteria are appropriate for all manuscripts.
Table 1: Rigor
NIH rigor criteria are not applicable to paper type.Table 2: Resources
Software and Algorithms Sentences Resources Simulations were run using the CHARMM36 forcefield33–35,63 and OpenMM version 7.5.0.64 We use the NPT ensemble, achieved with a Monte Carlo barostat set at 1 atm with volume moves attempted every 100 steps. OpenMMsuggested: (OpenMM, RRID:SCR_000436)Results from OddPub: We did not detect open data. We also did not detect open code. Researchers are encouraged to share open data when possible (see Nature blog).
Results from LimitationRecognizer: An explicit section about the limitations of the techniques employed in this study was not found. We encourage authors to address study limitations.Res…
SciScore for 10.1101/2021.03.02.433608: (What is this?)
Please note, not all rigor criteria are appropriate for all manuscripts.
Table 1: Rigor
NIH rigor criteria are not applicable to paper type.Table 2: Resources
Software and Algorithms Sentences Resources Simulations were run using the CHARMM36 forcefield33–35,63 and OpenMM version 7.5.0.64 We use the NPT ensemble, achieved with a Monte Carlo barostat set at 1 atm with volume moves attempted every 100 steps. OpenMMsuggested: (OpenMM, RRID:SCR_000436)Results from OddPub: We did not detect open data. We also did not detect open code. Researchers are encouraged to share open data when possible (see Nature blog).
Results from LimitationRecognizer: An explicit section about the limitations of the techniques employed in this study was not found. We encourage authors to address study limitations.Results from TrialIdentifier: No clinical trial numbers were referenced.
Results from Barzooka: We did not find any issues relating to the usage of bar graphs.
Results from JetFighter: We did not find any issues relating to colormaps.
Results from rtransparent:- Thank you for including a conflict of interest statement. Authors are encouraged to include this statement when submitting to a journal.
- No funding statement was detected.
- No protocol registration statement was detected.
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