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2,331 to 2,340 of 2,438 Results
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
getphi.tcl
Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning
application/x-tcl - 578 B - MD5: 67b6413cec37c10b655ca26dc4d6bcf3
TCL code to extract phi and psi angles
NSP10.conf
Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning
Plain Text - 1.3 KB - MD5: 2827536c91c50ebc66bc5b207ef5628f
NAMD configuration file
NSP10_param.namd
Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning
Unknown - 732 B - MD5: ab121bdee1c16799c6f9f66fb687a521
NAMD parameter file
NSP10.Rnw
Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning
Unknown - 1.6 KB - MD5: 0c97c988288671c51fada4cd1888053b
README.txt
Jan 26, 2022 - Replication Data for: Optimizing Peptide Inhibitors of SARS-Cov-2 nsp10/nsp16 Methyltransferase Predicted through Molecular Simulation and Machine Learning
Plain Text - 382 B - MD5: 5e276e3cc77ba4a4084fbe35889c8f47
File List
Arc_WaT.tbx
Sep 21, 2021 - ArcGIS Wave Transformation toolbox - ArcWaT
Unknown - 33.5 KB - MD5: 9cccd9169a18aa2d25f9dd4b7550c282
Code
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