RDKit
Open-source cheminformatics and machine learning.
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DistanceConstraints.h File Reference
#include <RDGeneral/export.h>
#include <vector>
#include <iostream>
#include "Contrib.h"

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Classes

struct  ForceFields::DistanceConstraintContribsParams
 
class  ForceFields::DistanceConstraintContribs
 A term to capture all flat bottom distance constraint potentials. More...
 

Namespaces

namespace  ForceFields