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fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map - #5450

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njzjz merged 8 commits into
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wanghan-iapcm:fix-pt-expt-lammps-no-atom-map
May 23, 2026
Merged

fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map#5450
njzjz merged 8 commits into
deepmodeling:masterfrom
wanghan-iapcm:fix-pt-expt-lammps-no-atom-map

refactor(nlist): drop nprocs param from 4-arg ctor; mirror matrix com…

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