[AMBER] AmberTools bug in pyresp_gen.py

From: Vlad via AMBER <amber.ambermd.org>
Date: Wed, 4 Mar 2026 10:57:38 +1100

Dear Amber Developers,

I would like to propose the acceptance of a patch for AmberTools 24 and
25 that addresses an issue with Python compatibility when using Pandas
version 3.00 or later.

This issue is not machine-dependent but is affected by the version of
Pandas being used; specifically, the version from the latest Miniforge
may produce a syntax error.

In 3 tests in AmberTools/test/py_resp/CH3SCH3-pyrespgen, pyresp_gen.py
will fail without this patch.

A patch was kindly provided by Hirosuke Hotta from Fujitsu, Japan.

Best regards, Vlad



_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber

Received on Tue Mar 03 2026 - 16:00:03 PST
Custom Search