|
| 1 | +# To be filled by the author(s) at the time of submission |
| 2 | +# ------------------------------------------------------- |
| 3 | + |
| 4 | +# Title of the article: |
| 5 | +# - For a successful replication, it shoudl be prefixed with "[Re]" |
| 6 | +# - For a failed replication, it should be prefixed with "[¬Re]" |
| 7 | +# - For other article types, no instruction (but please, not too long) |
| 8 | +title: "[Rp] Structural flexibility in proteins - impact of the crystal environment" |
| 9 | + |
| 10 | +# List of authors with name, orcid number, email and affiliation |
| 11 | +# Affiliation "*" means contact author |
| 12 | +authors: |
| 13 | + - name: Konrad Hinsen |
| 14 | + orcid: 0000-0003-0330-9428 |
| 15 | + email: konrad.hinsen@cnrs.fr |
| 16 | + affiliations: 1,2,* |
| 17 | + |
| 18 | +# List of affiliations with code (corresponding to author affiliations), name |
| 19 | +# and address. You can also use these affiliations to add text such as "Equal |
| 20 | +# contributions" as name (with no address). |
| 21 | +affiliations: |
| 22 | + - code: 1 |
| 23 | + name: Centre de Biophysique Moléculaire, CNRS UPR4301 |
| 24 | + address: Orléans, France |
| 25 | + |
| 26 | + - code: 2 |
| 27 | + name: Synchrotron SOLEIL, Division Expériences |
| 28 | + address: Gif sur Yvette, France |
| 29 | + |
| 30 | +# List of keywords (adding the programming language might be a good idea) |
| 31 | +keywords: protein structure, protein crystals, normal modes, Python |
| 32 | + |
| 33 | +# Code URL and DOI (url is mandatory for replication, doi after acceptance) |
| 34 | +# You can get a DOI for your code from Zenodo, |
| 35 | +# see https://guides.github.com/activities/citable-code/ |
| 36 | +code: |
| 37 | + - url: https://github.com/khinsen/rescience-ten-year-challenge-paper-3 |
| 38 | + - doi: |
| 39 | + - swh: swh:1:dir:8a73b8438b411cc8a58a3db7789ff45690808afa |
| 40 | + |
| 41 | +# Data URL and DOI (optional if no data) |
| 42 | +data: |
| 43 | + - url: |
| 44 | + - doi: |
| 45 | + |
| 46 | +# Information about the original article that has been replicated |
| 47 | +replication: |
| 48 | + - cite: K. Hinsen, Structural flexibility in proteins - impact of the crystal environment, Bioinformatics 24:521 (2008) |
| 49 | + - bib: HinsenStructuralflexibilityproteins2008 |
| 50 | + - url: https://academic.oup.com/bioinformatics/article-pdf/24/4/521/16884353/btm625.pdf |
| 51 | + - doi: 10.1093/bioinformatics/btm625 |
| 52 | + |
| 53 | +# Don't forget to surround abstract with double quotes |
| 54 | +abstract: "Reproduction attempt of K. Hinsen, Structural flexibility in proteins: impact |
| 55 | + of the crystal environment, Bioinformatics 24:521 (2008). The code published |
| 56 | + with the original article could be modified to work on a modern computer, |
| 57 | + and produced sufficiently similar results. However, it proved insufficient |
| 58 | + for a complete replication of all the results." |
| 59 | + |
| 60 | +# Bibliography file (yours) |
| 61 | +bibliography: bibliography.bib |
| 62 | + |
| 63 | +# Type of the article |
| 64 | +# Type can be: |
| 65 | +# * Editorial |
| 66 | +# * Letter |
| 67 | +# * Replication |
| 68 | +type: Reproduction |
| 69 | + |
| 70 | +# Scientific domain of the article (e.g. Computational Neuroscience) |
| 71 | +# (one domain only & try to be not overly specific) |
| 72 | +domain: Biophysics |
| 73 | + |
| 74 | +# Coding language (main one only if several) |
| 75 | +language: Python |
| 76 | + |
| 77 | + |
| 78 | +# To be filled by the author(s) after acceptance |
| 79 | +# ----------------------------------------------------------------------------- |
| 80 | + |
| 81 | +# For example, the URL of the GitHub issue where review actually occured |
| 82 | +review: |
| 83 | + - url: https://github.com/ReScience/submissions/issues/14 |
| 84 | + |
| 85 | +contributors: |
| 86 | + - name: Marc André Delsuc |
| 87 | + orcid: 0000-0002-1400-5326 |
| 88 | + role: editor |
| 89 | + - name: François-Xavier Coudert |
| 90 | + orcid: 0000-0001-5318-3910 |
| 91 | + role: reviewer |
| 92 | + - name: |
| 93 | + orcid: |
| 94 | + role: reviewer |
| 95 | + |
| 96 | +# This information will be provided by the editor |
| 97 | +dates: |
| 98 | + - received: January 30, 2020 |
| 99 | + - accepted: March 19, 2020 |
| 100 | + - published: June 9, 2020 |
| 101 | + |
| 102 | +# This information will be provided by the editor |
| 103 | +article: |
| 104 | + - number: 5 |
| 105 | + - doi: 10.5281/zenodo.3886447 |
| 106 | + - url: https://zenodo.org/record/3886447/files/article.pdf |
| 107 | + |
| 108 | +# This information will be provided by the editor |
| 109 | +journal: |
| 110 | + - name: "ReScience C" |
| 111 | + - issn: 2430-3658 |
| 112 | + - volume: 6 |
| 113 | + - issue: 1 |
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