翻译NOTE 1: Code tested with Python 3.5.2 and 3.7.3. Your version: 3.8.2 (tags/v3.8.2:7b3ab59, Feb 25 2020, 23:03:10) [MSC v.1916 64 bit (AMD64)] NOTE 2: Code tested with NetworkX 2.3. Your version: 2.3 NOTE 3: Please be sure to use the same version of CGenFF in your simulations that was used during parameter generation: --Version of CGenFF detected in charmm36-jul2022.ff/forcefield.doc : 4.6 WARNING: CGenFF versions are not equivalent! ERROR: Could not detect CGenFF version. Exiting.
时间: 2024-04-17 20:23:11 浏览: 210
wb_lpc_latest.tar.gz_And Yet ..._LPC BIT I/O_VHDL DMA_WISHBONE L
注意 1: 代码已在Python 3.5.2和3.7.3上进行测试。您的版本是:3.8.2(tags/v3.8.2:7b3ab59, Feb 25 2020, 23:03:10)[MSC v.1916 64 bit (AMD64)]
注意 2: 代码已在NetworkX 2.3上进行测试。您的版本是:2.3
注意 3: 请确保在模拟中使用与参数生成期间使用的相同版本的CGenFF:
- 在 charmm36-jul2022.ff/forcefield.doc 中检测到的CGenFF版本为 4.6
警告: CGenFF 版本不一致!
错误: 无法检测到 CGenFF 版本。程序退出。
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