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Gromacs
2026.0-dev-20251119-5f0a571d
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Directory dependency graph for math:Directories | |
| directory | include |
| directory | tests |
Files | |
| file | 3dtransforms.cpp |
| file | coordinatetransformation.cpp |
| Implements coordinate transformation routines. | |
| file | densityfit.cpp |
| Implements density similarity measures and their derivatives. | |
| file | densityfittingforce.cpp |
| Implements density fitting forces. | |
| file | do_fit.cpp |
| file | exponentialmovingaverage.cpp |
| Implements routines to calculate an exponential moving average. | |
| file | functions.cpp |
| Implements simple math functions. | |
| file | gausstransform.cpp |
| Implements Gaussian function evaluations on lattices and related functionality. | |
| file | invertmatrix.cpp |
| Routines to invert 3x3 matrices. | |
| file | neldermead.cpp |
| Implements routines in neldermead.h . | |
| file | nrjac.cpp |
| Defines wrapper functions for higher-level matrix functions. | |
| file | optimization.cpp |
| Implements routines in optimization.h . | |
| file | utilities.cpp |
1.8.5