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SamDozer
MolDynX-Tools
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Rename mdforge to MolDynX Tools (moldynx)
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#2
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SamDozer
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Sep 23, 2026
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Rename mdforge to MolDynX Tools (moldynx)
#2
SamDozer
merged 5 commits into
main
SamDozer/MolDynX-Tools:main
from
feature/moldynx-dataset-pipeline
SamDozer/MolDynX-Tools:feature/moldynx-dataset-pipeline
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Commits on Sep 23, 2026
Rename mdforge to MolDynX Tools (moldynx)
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Intake: choose the production run by evidence, report what is missing
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Track the curated test fixtures that *.log/*.edr ignore rules excluded
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PBC: diagnose, treat and prove the solute trajectory in one pass
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Equilibration audit, interface suite, multi-frame-safe SASA; record next steps
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