Changeset ea30e6 for src/Python/modules.hpp

Timestamp:

Apr 23, 2021, 8:43:45 PM (5 years ago)

Author:

Frederik Heber <frederik.heber@…>

Branches:

Candidate_v1.7.0, stable

Children:

51d384a

Parents:

38bcbe

git-author:

Frederik Heber <frederik.heber@…> (10/07/20 19:05:19)

git-committer:

Frederik Heber <frederik.heber@…> (04/23/21 20:43:45)

Message:

Added python getters for selected atom ids and elements.

File:

• src/Python/modules.hpp (modified) (2 diffs)

src/Python/modules.hpp

@@ -16 +16 @@
 #include <vector>
 
+#include "types.hpp"
+
 namespace MoleCuilder {
 
@@ -24 +26 @@
 void module_wait();
 
+typedef std::vector<atomId_t> atomIdVec;
+typedef std::vector<atomicNumber_t> elementVec;
 typedef std::vector<double> doubleVec;
 
 doubleVec module_getBoundingBox();
 double module_getDomainVolume();
+atomIdVec module_getSelectedAtomIds();
+elementVec module_getSelectedAtomElements();
 double module_getSelectedMolarMass();