source:
src/Atom@
91c409
| Name | Size | Rev | Age | Author | Last Change |
|---|---|---|---|---|---|
| ../ | |||||
| CopyAtoms | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | ||
| unittests | 4ecb2d | 9 years | Moved LinearAlgebra sub-package into ThirdParty folder. - needed to … | ||
| atom.cpp | 9.3 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
| atom.hpp | 8.5 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
| atom_atominfo.cpp | 18.7 KB | 4b2207 | 4 years | FIX: SaveEnergiesAction did not use correct units. - temperature was … | |
| atom_atominfo.hpp | 11.0 KB | d40189 | 5 years | OutputTemperature -> OutputEnergies, SaveTemperature -> SaveEnergies. … | |
| atom_bondedparticle.cpp | 13.6 KB | 51d384a | 5 years | Added BondedParticle::IsBondedTo that uses current worldtime. | |
| atom_bondedparticle.hpp | 2.4 KB | 51d384a | 5 years | Added BondedParticle::IsBondedTo that uses current worldtime. | |
| atom_bondedparticleinfo.cpp | 3.9 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
| atom_bondedparticleinfo.hpp | 4.7 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
| atom_graphnode.cpp | 2.1 KB | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | |
| atom_graphnode.hpp | 913 bytes | 6f0841 | 14 years | Shifted all modules related to atoms into own subfolder src/Atom/ - … | |
| atom_graphnodeinfo.cpp | 1.4 KB | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | |
| atom_graphnodeinfo.hpp | 1.4 KB | 6f0841 | 14 years | Shifted all modules related to atoms into own subfolder src/Atom/ - … | |
| atom_observable.cpp | 1.6 KB | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | |
| atom_observable.hpp | 1.4 KB | b71881 | 10 years | Added select() and unselect() functions to atom and molecule, also … | |
| atom_particleinfo.cpp | 1.9 KB | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | |
| atom_particleinfo.hpp | 1.4 KB | ea0c8b | 14 years | FIX: ParticleInfo did use ptr instead of const ref in copy cstor. - … | |
| AtomicInfo.cpp | 4.3 KB | 6145577 | 8 years | FIX: ForceAnnealingAction's Undo is again working. - … | |
| AtomicInfo.hpp | 1.1 KB | 6145577 | 8 years | FIX: ForceAnnealingAction's Undo is again working. - … | |
| AtomObserver.cpp | 1.7 KB | 9eb71b3 | 8 years | Commented out MemDebug include and Memory::ignore. - MemDebug clashes … | |
| AtomObserver.hpp | 844 bytes | d4ba3f | 10 years | Extracted common code out of Molecule/AtomObserver into … | |
| AtomSet.hpp | 8.2 KB | d40189 | 5 years | OutputTemperature -> OutputEnergies, SaveTemperature -> SaveEnergies. … | |
| Makefile.am | 3.4 KB | 214240 | 13 years | FIX: Most of the includedirs were wrongly set. - each just needs to … | |
| TesselPoint.cpp | 2.1 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
| TesselPoint.hpp | 1.9 KB | 8c6b68 | 8 years | atom::removeStep() extended to removing interval of steps. - … | |
|
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