计算化学公社

 找回密码 Forget password
 注册 Register
Views: 185|回复 Reply: 3
打印 Print 上一主题 Last thread 下一主题 Next thread

[Linux] Debian13安装Schrodinger2025-3出现libxtb.so.6错误

[复制链接 Copy URL]

3

帖子

0

威望

37

eV
积分
40

Level 2 能力者

跳转到指定楼层 Go to specific reply
楼主
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
复制代码

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/"
复制代码


烦请各位大佬帮忙看一下如何解决,谢谢!



16

帖子

0

威望

463

eV
积分
479

Level 3 能力者

2#
发表于 Post on 2025-11-22 09:26:48 | 只看该作者 Only view this author
schrodinger安装前需要安装一系列依赖,官网有说明

220

帖子

0

威望

497

eV
积分
717

Level 4 (黑子)

3#
发表于 Post on 2025-11-22 10:12:51 | 只看该作者 Only view this author
用rockylinux8.10以上的版本,应该没有问题。

3

帖子

0

威望

37

eV
积分
40

Level 2 能力者

4#
 楼主 Author| 发表于 Post on 2025-11-22 14:13:07 | 只看该作者 Only view this author
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

本版积分规则 Credits rule

手机版 Mobile version|北京科音自然科学研究中心 Beijing Kein Research Center for Natural Sciences|京公网安备 11010502035419号|计算化学公社 — 北京科音旗下高水平计算化学交流论坛 ( 京ICP备14038949号-1 )|网站地图

GMT+8, 2026-1-23 20:24 , Processed in 0.828219 second(s), 20 queries , Gzip On.

快速回复 返回顶部 返回列表 Return to list