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Commit 3f7df800 authored by Wang, Leping's avatar Wang, Leping
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generate more cif files for example

parent d1e0d27b
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example/generation_config.sh
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...@@ -36,7 +36,7 @@ USE_CONFORMERS=4 ...@@ -36,7 +36,7 @@ USE_CONFORMERS=4
MOLECULE_NUM_IN_CELL=1 MOLECULE_NUM_IN_CELL=1
SPACE_GROUP_LIST="14,61" SPACE_GROUP_LIST="14,61"
ADD_NAME="XULDUD" ADD_NAME="XULDUD"
NUM_GENERATION=100 NUM_GENERATION=400
MAX_WORKERS=16 MAX_WORKERS=16
MODE="all" MODE="all"
OUTPUT_DIR="csp_results" OUTPUT_DIR="csp_results"
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