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ali-m-dinani/reaxkit: ReaxKit v1.0.0: Core File Handling & Analysis

integration_instructionsResearch softwarekeyboard_double_arrow_right Software 04 Feb 2026Publisher:Zenodo
Authors: ali-m-dinani;

doi: 10.5281/zenodo.18485383 , 10.5281/zenodo.18485384

ali-m-dinani/reaxkit: ReaxKit v1.0.0: Core File Handling & Analysis

Abstract

Initial public release of ReaxKit. This release provides: A modular Python toolkit for parsing, analyzing, and visualizing ReaxFF outputs Structured handlers for core ReaxFF files (e.g. xmolout, fort.7) Composed and per-file analysis workflows A CLI interface with autogenerated help and introspection Automatically generated API documentation and project website This version establishes the public API and documentation foundation for future development.

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    popularity
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    influence
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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