Setting up run for TEM-1

samgelman · samgelman · commit 7f66a182e123 · 2023-05-24T15:42:57.000-05:00
diff --git a/htcondor/run_defs/tem-1_1.txt b/htcondor/run_defs/tem-1_1.txt
@@ -0,0 +1,14 @@
+--run_type
+energize
+--run_name
+tem-1_1
+--energize_args_fn
+energize_args/condor_set_2.txt
+--master_variant_fn
+variant_lists/AF-Q6SJ61-F1-model_v4_p_all_NS-1.txt
+variant_lists/AF-Q6SJ61-F1-model_v4_p_all_NS-2.txt
+variant_lists/AF-Q6SJ61-F1-model_v4_p_subvariants_TN-5M_MAXS-5_MINS-3_DB-0_RS-494463854.txt
+--variants_per_job
+-1
+--github_tag
+v0.7.10
diff --git a/variant_lists/vlist_defs/tem-1_all_doubles.txt b/variant_lists/vlist_defs/tem-1_all_doubles.txt
@@ -0,0 +1,5 @@
+all
+--pdb_fn
+pdb_files/prepared_pdb_files/AF-Q6SJ61-F1-model_v4_p.pdb
+--num_subs_list
+2
diff --git a/variant_lists/vlist_defs/tem-1_all_singles.txt b/variant_lists/vlist_defs/tem-1_all_singles.txt
@@ -0,0 +1,5 @@
+all
+--pdb_fn
+pdb_files/prepared_pdb_files/AF-Q6SJ61-F1-model_v4_p.pdb
+--num_subs_list
+1
diff --git a/variant_lists/vlist_defs/tem-1_subvariants_1.txt b/variant_lists/vlist_defs/tem-1_subvariants_1.txt
@@ -0,0 +1,9 @@
+subvariants
+--pdb_fn
+pdb_files/prepared_pdb_files/AF-Q6SJ61-F1-model_v4_p.pdb
+--target_num
+5000000
+--max_num_subs
+5
+--min_num_subs
+3

-Original file line number
+Diff line change
@@ @@ -0,0 +1,5 @@ @@
 +all
 +--pdb_fn
 +pdb_files/prepared_pdb_files/AF-Q6SJ61-F1-model_v4_p.pdb
 +--num_subs_list
 +2