Co-authored-by: ptosco <paolo.tosco@novartis.com>
This commit is contained in:
Paolo Tosco
2024-11-20 09:09:56 +01:00
committed by GitHub
parent db0df54347
commit fc6e37d11e
3 changed files with 4 additions and 4 deletions

View File

@@ -41,7 +41,7 @@
#include <ForceField/UFF/AngleBend.h>
#include <ForceField/UFF/BondStretch.h>
#include <ForceField/UFF/Contribs.h>
#include <ForceField/UFF/DistanceConstraint.h>
#include <ForceField/DistanceConstraint.h>
#include <ForceField/UFF/Nonbonded.h>
#include <ForceField/UFF/TorsionAngle.h>
#include <ForceField/UFF/Inversion.h>
@@ -59,7 +59,7 @@
%include <ForceField/UFF/Params.h>
%include <ForceField/UFF/AngleBend.h>
%include <ForceField/UFF/BondStretch.h>
%include <ForceField/UFF/DistanceConstraint.h>
%include <ForceField/DistanceConstraint.h>
%include <ForceField/UFF/Nonbonded.h>
%include <ForceField/UFF/TorsionAngle.h>
%include <ForceField/UFF/Inversion.h>

View File

@@ -181,7 +181,7 @@ typedef unsigned long long int uintmax_t;
%shared_ptr(ForceFields::ForceFieldContrib);
%shared_ptr(ForceFields::UFF::AngleBendContrib);
%shared_ptr(ForceFields::UFF::BondStretchContrib);
%shared_ptr(ForceFields::UFF::DistanceConstraintContrib);
%shared_ptr(ForceFields::DistanceConstraintContrib);
%shared_ptr(ForceFields::UFF::vdWContrib);
%shared_ptr(ForceFields::UFF::TorsionAngleContrib);
%shared_ptr(ForceFields::UFF::InversionContrib);

View File

@@ -125,7 +125,7 @@ typedef unsigned long long int uintmax_t;
%shared_ptr(ForceFields::ForceFieldContrib);
%shared_ptr(ForceFields::UFF::AngleBendContrib);
%shared_ptr(ForceFields::UFF::BondStretchContrib);
%shared_ptr(ForceFields::UFF::DistanceConstraintContrib);
%shared_ptr(ForceFields::DistanceConstraintContrib);
%shared_ptr(ForceFields::UFF::vdWContrib);
%shared_ptr(ForceFields::UFF::TorsionAngleContrib);
%shared_ptr(ForceFields::UFF::InversionContrib);