Mercurial > repos > bgruening > rdock_rbcavity

changeset 4:df7ba4536f77 draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/rdock commit e9c627440028cfd2c743462927672e0c5e3576aa"
author bgruening
date Sat, 25 Apr 2020 08:56:29 -0400
parents 2f218be61685
children 82193638d0c5
files test-data/receptor.prm test-data/wrong_receptor.prm
diffstat 2 files changed, 6 insertions(+), 0 deletions(-) [+]
line wrap: on
line diff
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/receptor.prm	Sat Apr 25 08:56:29 2020 -0400
@@ -0,0 +1,3 @@
+RBT_PARAMETER_FILE_V1.00
+RECEPTOR_FILE receptor.mol2
+RECEPTOR_FLEX 3.0
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/wrong_receptor.prm	Sat Apr 25 08:56:29 2020 -0400
@@ -0,0 +1,3 @@
+RBT_PARAMETER_FILE_V1.00
+RECEPTOR_FILE a_terrible_mistake.mol2
+RECEPTOR_FLEX 3.0