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Materials-Consortia/optimade-maker: v0.9.0

Authors: Eimre, Kristjan; Evans, Matthew; Macaulay, Bud; Wang, Xing; Yu, Jusong; Marzari, Nicola; Rignanese, Gian-Marco; +1 Authors

Materials-Consortia/optimade-maker: v0.9.0

Abstract

Tools for making OPTIMADE APIs from various formats of structural data (e.g. an archive of CIF files). This repository contains the src/optimade-maker Python package and the corresponding CLI tool optimake, which together provide this functionality. Features include definition of a config file format (optimade.yaml) for annotating data archives to be used in the OPTIMADE ecosystem; conversion of the raw data into corresponding OPTIMADE types using pre-existing parsers (e.g., ASE for structures); conversion of the annotated data archive into the OPTIMADE JSON Lines file format (spec) that can be ingested into a database and used to serve a full OPTIMADE API. serving either an annotated data archive or a JSON Lines file as an OPTIMADE API (using the optimade-python-tools reference server implementation).

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    popularity
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    influence
    This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
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    impulse
    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
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Powered by OpenAIRE graph
Found an issue? Give us feedback
selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average