diff options
Diffstat (limited to 'rescinnamine_pyrx_binding_affinity.csv')
| -rw-r--r-- | rescinnamine_pyrx_binding_affinity.csv | 10 |
1 files changed, 10 insertions, 0 deletions
diff --git a/rescinnamine_pyrx_binding_affinity.csv b/rescinnamine_pyrx_binding_affinity.csv new file mode 100644 index 0000000..20c7952 --- /dev/null +++ b/rescinnamine_pyrx_binding_affinity.csv @@ -0,0 +1,10 @@ +Ligand,Binding Affinity,rmsd/ub, rmsd/lb
+6lu7cov_rescinnamine,-14.3,0.0,0.0
+6lu7cov_rescinnamine,-14.3,5.197,2.853
+6lu7cov_rescinnamine,-14.1,8.62,2.953
+6lu7cov_rescinnamine,-14.0,8.807,2.8
+6lu7cov_rescinnamine,-13.6,32.186,31.024
+6lu7cov_rescinnamine,-13.4,28.397,25.721
+6lu7cov_rescinnamine,-13.1,34.441,31.678
+6lu7cov_rescinnamine,-13.1,33.23,31.694
+6lu7cov_rescinnamine,-13.1,18.4,17.356
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