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标题: Debian13安装Schrodinger2025-3出现libxtb.so.6错误 [打印本页]

作者
Author:
AoyuJiao    时间: 2025-11-21 22:31
标题: Debian13安装Schrodinger2025-3出现libxtb.so.6错误
求助各位:我最近在Debian13上安装Schrodinger2025-3时出现报错:
  1. Traceback (most recent call last):
  2.   File "/opt/schrodinger2025-3/mmshare-v7.1/python/scripts/check_deps.py", line 9, in <module>
  3.     from schrodinger.utils import installation_check
  4.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/utils/installation_check.py", line 23, in <module>
  5.     from schrodinger.job import jobcontrol
  6.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/job/jobcontrol.py", line 42, in <module>
  7.     import schrodinger.infra.mm as mm
  8.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/infra/mm.py", line 44, in <module>
  9.     from schrodinger.infra import mmcheck
  10.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/infra/mmcheck.py", line 7, in <module>
  11.     import pymmlibs
  12.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/pymmlibs.py", line 21, in <module>
  13.     from _pymmlibs import *
  14. ImportError: libxtb.so.6: cannot enable executable stack as shared object requires: Invalid argument
  15. ** WARNING: Skipping dependency verification
  16. Traceback (most recent call last):
  17.   File "<frozen runpy>", line 198, in _run_module_as_main
  18.   File "<frozen runpy>", line 88, in _run_code
  19.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/utils/postinstall.py", line 16, in <module>
  20.     from schrodinger.utils.fileutils import get_mmshare_data_dir
  21.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/utils/fileutils.py", line 49, in <module>
  22.     from schrodinger.infra import mm
  23.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/infra/mm.py", line 44, in <module>
  24.     from schrodinger.infra import mmcheck
  25.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/schrodinger/infra/mmcheck.py", line 7, in <module>
  26.     import pymmlibs
  27.   File "/opt/schrodinger2025-3/internal/lib/python3.11/site-packages/pymmlibs.py", line 21, in <module>
  28.     from _pymmlibs import *
  29. ImportError: libxtb.so.6: cannot enable executable stack as shared object requires: Invalid argument
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安装程序在进行到询问“是否启用GUI配置“时终止,安装失败。

我的操作系统详情是
  1. PRETTY_NAME="Debian GNU/Linux 13 (trixie)"
  2. NAME="Debian GNU/Linux"
  3. VERSION_ID="13"
  4. VERSION="13 (trixie)"
  5. VERSION_CODENAME=trixie
  6. DEBIAN_VERSION_FULL=13.2
  7. ID=debian
  8. HOME_URL="https://www.debian.org/"
  9. SUPPORT_URL="https://www.debian.org/support"
  10. BUG_REPORT_URL="https://bugs.debian.org/"
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烦请各位大佬帮忙看一下如何解决,谢谢!




作者
Author:
爱喝茶    时间: 2025-11-22 09:26
schrodinger安装前需要安装一系列依赖,官网有说明
作者
Author:
yzh    时间: 2025-11-22 10:12
用rockylinux8.10以上的版本,应该没有问题。
作者
Author:
AoyuJiao    时间: 2025-11-22 14:13
爱喝茶 发表于 2025-11-22 09:26
schrodinger安装前需要安装一系列依赖,官网有说明


官网写的所需的安装包已经都装好了,参考网址:
https://github.com/schrodinger/l ... 2025-3/packages.txt






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