- 08 Apr, 2026 1 commit
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Wang, Leping authored
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- 05 Apr, 2026 2 commits
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Wang, Leping authored
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Wang, Leping authored
(molecular, crystal structure, compute, run mode, path) - Refactor search_gen_proc.sh to source config.sh instead of hardcoding parameters, with optional config path argument - Refactor structure_generate.py to load config.sh via exec(), replacing hardcoded values with config-driven parameters - Remove mace-bench (the relaxation part, it will be replaced by updated seperate mace-bench project )
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