diff --git a/PanDDA2/modulefile b/PanDDA2/modulefile index 779fe14..4a65bdf 100644 --- a/PanDDA2/modulefile +++ b/PanDDA2/modulefile @@ -10,6 +10,12 @@ PanDDA 2 (pandda_2_gemmi) in a self-contained python 3.9 venv, CNN scoring models pre-downloaded at build time. ccp4/9.0 is auto-loaded as a runtime dependency for pandda.inspect / pandda.export. Main entry point: pandda2.analyse + +NOTE: classic PanDDA 1 (panddas 0.2.x, python 2) is broken in ccp4 >= 7.1; +upstream pins it to ccp4 7.0.72 and recommends 7.0.067 for working +pandda.inspect / pandda.export. The ccp4/9.0 versions loaded here are +UNVERIFIED - check inspect/export results before trusting them, or use +PanDDA2Inspect (https://github.com/ConorFWild/PanDDA2Inspect). " setenv PANDDA2_ENV $PREFIX/venv