compile Xtrapol8 v1.2.8 with phenix 1.21
This commit is contained in:
@@ -1,5 +1,7 @@
|
||||
### Installation remarks
|
||||
|
||||
March 2026: From v1.2.6 on, seem to work with phenix/1.21 versions. v1.2.8 is compiled with phenix/1.21 version and needs to be tested to see whether it works.
|
||||
|
||||
According to Elke de Zitter (as of Spring 2024) Xtrapol8 only runs with the phenix/1.19 version.
|
||||
--> check for new releases...
|
||||
|
||||
|
||||
+1
-1
@@ -12,6 +12,6 @@ pbuild::compile() {
|
||||
pbuild::install(){
|
||||
mkdir "$PREFIX/bin"
|
||||
cd "$PREFIX/bin"
|
||||
tar -xf "${PMODULES_DISTFILESDIR}/Xtrapol8-${V_PKG}.tar.gz" --strip-components=1
|
||||
tar -xf "${BUILDBLOCK_DIR}/Xtrapol8-${V_PKG}.tar.gz" --strip-components=1
|
||||
}
|
||||
|
||||
|
||||
@@ -3,10 +3,13 @@ Xtrapol8:
|
||||
defaults:
|
||||
group: MX
|
||||
relstage: unstable
|
||||
urls:
|
||||
- url: https://github.com/ElkeDeZitter/Xtrapol8/archive/refs/tags/v${V_PKG}.tar.gz
|
||||
urls:
|
||||
- url: https://github.com/ElkeDeZitter/Xtrapol8/archive/refs/tags/v.${V_PKG}.tar.gz
|
||||
name: Xtrapol8-${V_PKG}.tar.gz
|
||||
versions:
|
||||
1.2.1:
|
||||
config:
|
||||
runtime_deps: [phenix/phenix-1.19.1-4122]
|
||||
runtime_deps: [phenix/phenix-1.19.1-4122]
|
||||
1.2.8:
|
||||
config:
|
||||
runtime_deps: [phenix/1.21.1-5286]
|
||||
|
||||
+5
-1
@@ -3,7 +3,7 @@
|
||||
module-whatis "Xtrapol8 is software for the structure determination of low-occupancy states in crystallography"
|
||||
module-url "https://github.com/ElkeDeZitter/Xtrapol8"
|
||||
module-license "MIT license"
|
||||
module-maintainer "Greta Assmann - greta.assmann@psi.ch"
|
||||
module-maintainer "Dawn Duan - jiaxin.duan@psi.ch"
|
||||
|
||||
module-help "
|
||||
Xtrapol8 is software for the calculation of Fourier difference maps, extrapolated structure factors and estimation of the occupancy of at triggered state that occupies the crystal
|
||||
@@ -15,5 +15,9 @@ An introduction into Fourier difference maps, structure factor extrapolation and
|
||||
|
||||
If Xtrapol8 was useful in your project, please cite us: De Zitter, E., Coquelle, N., Oeser, P., Barends, T. R. M., Colletier, J.-P., Xtrapol8 enables automatic elucidation of low-
|
||||
occupancy intermediate-states in crystallographic studies, Communications Biology, 5(1):640, 2022. (https://www.nature.com/articles/s42003-022-03575-7)
|
||||
|
||||
urls:
|
||||
- url: https://github.com/ElkeDeZitter/Xtrapol8/archive/refs/tags/v${V_PKG}.tar.gz
|
||||
name: Xtrapol8-${V_PKG}.tar.gz
|
||||
"
|
||||
|
||||
|
||||
Reference in New Issue
Block a user