From db964dace54b72fa69bcb8d1b3037350c9e8cfc0 Mon Sep 17 00:00:00 2001
From: Gabriel Studer <gabriel.studer@unibas.ch>
Date: Tue, 6 Oct 2020 19:30:30 +0200
Subject: [PATCH] export MeanlDDT data getter
---
modules/seq/alg/pymod/wrap_seq_alg.cc | 5 +++++
1 file changed, 5 insertions(+)
diff --git a/modules/seq/alg/pymod/wrap_seq_alg.cc b/modules/seq/alg/pymod/wrap_seq_alg.cc
index 3766ad7c7..79873278e 100644
--- a/modules/seq/alg/pymod/wrap_seq_alg.cc
+++ b/modules/seq/alg/pymod/wrap_seq_alg.cc
@@ -79,6 +79,10 @@ list DistToMeanGetData(const Dist2MeanPtr d2m) {
return GetList(*d2m, d2m->GetNumResidues(), d2m->GetNumStructures());
}
+list MeanlDDTGetData(const MeanlDDTPtr ld) {
+ return GetList(*ld, ld->GetNumResidues(), ld->GetNumStructures());
+}
+
void AAPseudoCountsSimple(ProfileHandle& profile, Real a, Real b, Real c) {
AddAAPseudoCounts(profile, a, b, c);
}
@@ -243,6 +247,7 @@ void export_distance_analysis()
.def("ExportCsv", &MeanlDDT::ExportCsv, (arg("file_name")))
.def("ExportJson", &MeanlDDT::ExportJson, (arg("file_name")))
.def("GetJsonString", &MeanlDDT::GetJsonString)
+ .def("GetData", &MeanlDDTGetData)
;
}
--
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