source:
src/FunctionApproximation@
fdd789
| Name | Size | Rev | Age | Author | Last Change |
|---|---|---|---|---|---|
| ../ | |||||
| Subgraph | ddb998 | 9 years | tempcommit: Renamed PotentialSubgraph -> PotentialGraph. | ||
| unittests | c93e58 | 9 years | FIX: TrainingData used charges instead of atomic numbers to recognize … | ||
| Extractors.cpp | 16.3 KB | 36f3d3 | 9 years | tempcommit: Merge with ddb998b | |
| Extractors.hpp | 5.7 KB | ddb998 | 9 years | tempcommit: Renamed PotentialSubgraph -> PotentialGraph. | |
| FunctionApproximation.cpp | 13.9 KB | b40690 | 10 years | Fit..PotentialAction now allow setting maximum number of optimization … | |
| FunctionApproximation.hpp | 7.5 KB | b40690 | 10 years | Fit..PotentialAction now allow setting maximum number of optimization … | |
| FunctionArgument.cpp | 1.5 KB | fdd789 | 9 years | Added bonded flag to argument_t. | |
| FunctionArgument.hpp | 3.8 KB | fdd789 | 9 years | Added bonded flag to argument_t. | |
| FunctionModel.hpp | 6.3 KB | e1fe7e | 11 years | FunctionModel now uses list_of_arguments to split sequence of subsets … | |
| Makefile.am | 3.7 KB | ddb998 | 9 years | tempcommit: Renamed PotentialSubgraph -> PotentialGraph. | |
| TrainingData.cpp | 7.4 KB | c93e58 | 9 years | FIX: TrainingData used charges instead of atomic numbers to recognize … | |
| TrainingData.hpp | 4.7 KB | e1fe7e | 11 years | FunctionModel now uses list_of_arguments to split sequence of subsets … | |
| writeDistanceEnergyTable.hpp | 2.1 KB | 04cc7e | 13 years | Added pretty printer for distance-energy tables. - added … | |
|
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