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Tadah
MLIP
Graph
feature/structure_readers
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4
develop
feature/structure_readers
hpc
main
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Created with Raphaël 2.2.0
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WiP
feature/structu…
feature/structure_readers
WIP commit - 20250312_170718
Working tadah::mlip workspace
WiP
All?
All?
New classes with tests
Separation of data gathering from parsing
Fixed repeated index on forces printing. Enforce all class members to zero.
Working AFlow
Working NOMAD sreader
Integration of --sources into sreader and preditct
WIP: Works...
Edit .gitlab-ci.yml
main
main
Bypassing gemmi tests
Json lib use git tag
WIP: Structure Readers
WIP: Structure Readers
do not share cache across pipelines
Edit .gitlab-ci.yml
Renaming DatasetWriter to StructreWriter
Merge branch 'develop' of https://git.ecdf.ed.ac.uk/tadah/mlip into develop
develop
develop
Consistent (lack of) rescaling
WiP
hpc
hpc
WiP
Edit version.h
Edit version.h
Parser improvements
Parser improvements
Possibly... fixed parser
Possibly... fixed parser
Improved training weighting
WiP on weighting factors
const vol .castep GO
Sig fig control
wip
Sig fig control
wip
wip
Build update
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