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具体报错报告如下:
================================================================================
Materials Studio 2024 - PAM Hydrogel Amorphous Cell Builder
(MS2024 API Compatible Version - Uses Existing Structure Files)
================================================================================
SYSTEM COMPOSITION:
Solutes:
- PAM polymer chains: 9 (DP = 100 each)
- Zn2+ ions: 333
- OTf- ions: 666
Solvents:
- Glycerol acetate: 259
- Water molecules: 7743
Total molecules: 9010
[Step 0] Verifying input structure files...
[ERROR] The following input files are missing:
- Glycerol Acetate.xsd
- Zn2+.xsd
- OTF.xsd
- Acrylamide.xsd
- H2O.xsd
Please ensure all structure files exist in the project directory.
===================================================================================
= BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
= RANK 0 PID 47492 RUNNING AT DESKTOP-MQPLQRI
= EXIT STATUS: -1 (ffffffff)
===================================================================================
但是我的脚本中的文件名称是
xsd文件复制过来的,所有xsd文件均与脚本保持在同一文件夹中
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