Gromacs  2020.4
 All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Groups Pages
Functions
settletestrunners.h File Reference
#include "settletestdata.h"
+ Include dependency graph for settletestrunners.h:
+ This graph shows which files directly or indirectly include this file:

Description

Declaration of the SETTLE tests runners.

Declares the functions that do the buffer management and apply SETTLE constraints ("test runners").

Author
Artem Zhmurov zhmur.nosp@m.ov@g.nosp@m.mail..nosp@m.com

Functions

void gmx::test::applySettle (SettleTestData *testData, t_pbc pbc, bool updateVelocities, bool calcVirial, const std::string &testDescription)
 Apply SETTLE using CPU version of the algorithm. More...
 
void gmx::test::applySettleGpu (SettleTestData *testData, t_pbc pbc, bool updateVelocities, bool calcVirial, const std::string &testDescription)
 Apply SETTLE using GPU version of the algorithm. More...