From f913aa8afc5a1aa9416ffdb44a1da539aecaeba3 Mon Sep 17 00:00:00 2001
From: Tinka <38259497+tinkavidovic@users.noreply.github.com>
Date: Mon, 2 Mar 2020 10:51:44 +0100
Subject: Add files via upload

---
 valproic_acid_inding_energy.csv | 10 ++++++++++
 1 file changed, 10 insertions(+)
 create mode 100644 valproic_acid_inding_energy.csv

(limited to 'valproic_acid_inding_energy.csv')

diff --git a/valproic_acid_inding_energy.csv b/valproic_acid_inding_energy.csv
new file mode 100644
index 0000000..5ee1df2
--- /dev/null
+++ b/valproic_acid_inding_energy.csv
@@ -0,0 +1,10 @@
+Ligand,Binding Affinity,rmsd/ub, rmsd/lb
+6lu7cov_valproic_acid,-6.3,0.0,0.0
+6lu7cov_valproic_acid,-6.2,29.292,28.616
+6lu7cov_valproic_acid,-6.2,29.335,28.523
+6lu7cov_valproic_acid,-6.2,29.563,28.743
+6lu7cov_valproic_acid,-6.1,27.663,26.801
+6lu7cov_valproic_acid,-6.0,29.286,28.436
+6lu7cov_valproic_acid,-5.8,16.768,16.696
+6lu7cov_valproic_acid,-5.7,17.007,16.537
+6lu7cov_valproic_acid,-5.6,23.538,23.074
-- 
cgit v1.2.3