Loading…
Supplements for "Solvent Accessibility Promotes Rotamer Errors During Protein Modelling with Major Side-Chain Prediction Programs"
Supplements for "Solvent Accessibility Promotes Rotamer Errors During Protein Modelling with Major Side-Chain Prediction Programs" This supplement includes the following files: Main_v02.R --- Script in R language to process files (in "PDBs.zip") and produce the dataset ("Dat...
Saved in:
Main Authors: | , , , , |
---|---|
Format: | Dataset |
Language: | English |
Online Access: | Get full text |
Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Summary: | Supplements for "Solvent Accessibility Promotes Rotamer Errors During Protein Modelling with Major Side-Chain Prediction Programs"
This supplement includes the following files:
Main_v02.R --- Script in R language to process files (in "PDBs.zip") and produce the dataset ("Dataset_v02.csv")
PDBs.zip --- PDB files include filtered structures processed by three programs
Dataset_v02.csv --- final filtered version of dataset produced in R language (by "Main_v02.R").
Dataset key.txt --- key to column names in Dataset_v02.csv
The article featuring this dataset is published in:
Journal: Journal of Chemical Information and ModelingTitle: "Solvent Accessibility Promotes Rotamer Errors During Protein Modelling with Major Side-Chain Prediction Programs"Author(s): Hameduh, Tareq; Mokry, Michal ; Miller, Andrew ; Heger, Zbynek; Haddad, Yazan
https://pubs.acs.org/doi/10.1021/acs.jcim.3c00134
|
---|---|
ISSN: | 1549-960X |
DOI: | 10.1021/acs.jcim.3c00134 |