fix for pint bug

Acellera · Nov 7, 2024 · 7a1920a · 7a1920a
1 parent 3ec9ac1
commit 7a1920a
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Showing 4 changed files with 7 additions and 4 deletions.
diff --git a/htmd/__init__.py b/htmd/__init__.py
@@ -27,7 +27,7 @@
 if (not hasattr(main, "__file__")) and (
     (not os.path.isfile(reg_file))
     or os.getenv("LICENCE_ACCEPTED") == "YES"
-    or os.getenv("TRAVIS_REPO_SLUG")
+    or os.getenv("CI")
 ):
     print(
         "\nCopyright by Acellera Ltd. By executing you are accepting the License. In order to register, "

diff --git a/package/htmd/DEPENDENCIES b/package/htmd/DEPENDENCIES
@@ -10,7 +10,8 @@ scikit-learn >=1.3.2
 nglview >=3.1.2
 ipywidgets
 pandas >=1.1.2
-pint >=0.21
+pint =0.24.3
+flexparser <4 # Fix for pint bug https://github.com/hgrecco/pint/issues/2074 Remove once fixed and un-hardcode pint version
 acemd >=3.7.1
 ambertools >=22
 matplotlib >=3.7.3

diff --git a/package/htmd/DEPENDENCIES_MAC b/package/htmd/DEPENDENCIES_MAC
@@ -10,7 +10,8 @@ scikit-learn >=1.3.2
 nglview >=3.1.2
 ipywidgets
 pandas >=1.1.2
-pint >=0.21
+pint =0.24.3
+flexparser <4 # Fix for pint bug https://github.com/hgrecco/pint/issues/2074 Remove once fixed and un-hardcode pint version
 # acemd >=3.7.1
 ambertools >=22
 matplotlib >=3.7.3

diff --git a/package/htmd/DEPENDENCIES_WIN b/package/htmd/DEPENDENCIES_WIN
@@ -10,7 +10,8 @@ scikit-learn >=1.3.2
 nglview >=3.1.2
 ipywidgets
 pandas >=1.1.2
-pint >=0.21
+pint =0.24.3
+flexparser <4 # Fix for pint bug https://github.com/hgrecco/pint/issues/2074 Remove once fixed and un-hardcode pint version
 # acemd >=3.7.1
 # ambertools >=22
 matplotlib >=3.7.3