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Publication Year: 2022

71 to 80 of 85 Results

NP177_Sol_ion.psf Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/x-font-linux-psf - 10.0 MB - MD5: c68d16f7ac1493fa10786a87eb894cbd PSF file generated from simulation
NP198_Sol_ion.psf Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/x-font-linux-psf - 10.3 MB - MD5: 076ecc3b27dd548adc1cade52f1567ea PSF file generated from simulation
N_protein_177.pdb Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/vnd.palm - 501.4 KB - MD5: b35989ae1c9580b8dd83e8da3691e4bc Initial structure for NAMD
N-protein phi-psi.tab Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation Tabular Data - 20.1 MB - 846 Variables, 2001 Observations - UNF:6:waZeEVsr8IWiZWHJnN95kQ== data matrix containing phi and psi angles
NPS177A_Sol_ion.pdb Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/vnd.palm - 7.6 MB - MD5: 0ac39e744fdc0f90b059e74f1952d795 Initial structure for NAMD
NPS177A_Sol_ion.psf Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/x-font-linux-psf - 10.3 MB - MD5: 73203ce493f3955cc711816496631935 PSF file from NAMD simulation
NP_wb_ion .namd Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation Unknown - 7.2 KB - MD5: 961b60c57fe3dd2620404a2dca8150cf NAMD script
NP_wb_ion.psf Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation application/x-font-linux-psf - 10.3 MB - MD5: 36a4767163dcf5d7c2dda275f5144c6c PSF file from NAMD simulation
Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning Jan 26, 2022 Jafri, Saleet, 2022, "Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning", https://doi.org/10.13021/orc2020/OW4T3K, George Mason University Dataverse, V1 Scripts and files needed to reproduce manuscript results.
6ZPE.pdb Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning application/vnd.palm - 34.7 KB - MD5: 27dad315019a2081532dfbcb27ca9200 PDB structure file with initial structure

NP177_Sol_ion.psf

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/x-font-linux-psf - 10.0 MB -

PSF file generated from simulation

NP198_Sol_ion.psf

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/x-font-linux-psf - 10.3 MB -

PSF file generated from simulation

N_protein_177.pdb

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/vnd.palm - 501.4 KB -

Initial structure for NAMD

N-protein phi-psi.tab

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

Tabular Data - 20.1 MB - 846 Variables, 2001 Observations -

data matrix containing phi and psi angles

NPS177A_Sol_ion.pdb

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/vnd.palm - 7.6 MB -

Initial structure for NAMD

NPS177A_Sol_ion.psf

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/x-font-linux-psf - 10.3 MB -

PSF file from NAMD simulation

NP_wb_ion .namd

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

Unknown - 7.2 KB -

NAMD script

NP_wb_ion.psf

Feb 10, 2022 - Replication Data for: Active Site Prediction of Phosphorylated SARS-CoV-2 N-Protein Using Molecular Simulation

application/x-font-linux-psf - 10.3 MB -

PSF file from NAMD simulation

Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning

Jan 26, 2022

Jafri, Saleet, 2022, "Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning", https://doi.org/10.13021/orc2020/OW4T3K, George Mason University Dataverse, V1

Scripts and files needed to reproduce manuscript results.

6ZPE.pdb

Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning

application/vnd.palm - 34.7 KB -

PDB structure file with initial structure

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