Retry explicit minimum RDKit pin. [ref #335]

lohedges · lohedges · commit f743459bc202 · 2025-07-23T09:44:23.000+01:00
diff --git a/requirements_bss.txt b/requirements_bss.txt
@@ -12,7 +12,7 @@ openmmtools >= 0.21.5
 
 # Both ambertools and gromacs aren't available on Windows.
 # The arm64 gromacs package is current broken.
-ambertools >= 24 ; sys_platform != "win32"
+ambertools >= 22 ; sys_platform != "win32"
 gromacs ; sys_platform != "win32" and platform_machine != "arm64"
 
 # kartograf on Windows pulls in an openfe that has an old / incompatble
diff --git a/requirements_host.txt b/requirements_host.txt
@@ -5,7 +5,7 @@ gsl
 lazy_import
 libcblas
 libnetcdf
-librdkit-dev
+librdkit-dev >= 2024.09.6
 openmm >= 8.1
 pandas
 python
