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Gromacs
2026.0-dev-20251119-5f0a571d
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Directory dependency graph for math:Files | |
| file | 3dtransforms.h |
| file | arrayrefwithpadding.h |
| Declares gmx::ArrayRefWithPadding that refers to memory whose size includes padding for SIMD operations. | |
| file | boxmatrix.h |
| Declares routines to operate on 3x3 matrices that are boxes, ie. have zero values in their upper right triangle. | |
| file | coordinatetransformation.h |
| Declares coordinate transformation routines. | |
| file | densityfit.h |
| Declares density similarity measures and their derivatives. | |
| file | densityfittingforce.h |
| Declares classes to calculate density fitting forces. | |
| file | exponentialmovingaverage.h |
| Declares an exponential moving average class. | |
| file | gausstransform.h |
| Declares Gaussian function evaluations on lattices and related functionality. | |
| file | gmxcomplex.h |
| file | invertmatrix.h |
| Declares routines to invert 3x3 matrices. | |
| file | matrix.h |
| Declares special case of 3x3 matrix frequently used, and associated functions. | |
| file | multidimarray.h |
| Declares MultiDimArray. | |
| file | neldermead.h |
| Declare classes to aid Nelder-Mead downhill simplex optimisation. | |
| file | nrjac.h |
| Declares wrapper functions for higher-level matrix functions. | |
| file | optimization.h |
| Declare function optimization routines. | |
| file | paddedvector.h |
| Declares gmx::PaddedRVecVector. | |
1.8.5