43 |
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#include "UseTheForce/DarkSide/lj_interface.h" |
44 |
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#include "UseTheForce/DarkSide/sticky_interface.h" |
45 |
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#include "UseTheForce/ForceFieldFactory.hpp" |
46 |
+ |
#include "io/OptionSectionParser.hpp" |
47 |
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#include "io/DirectionalAtomTypesSectionParser.hpp" |
48 |
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#include "io/AtomTypesSectionParser.hpp" |
49 |
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#include "io/LennardJonesAtomTypesSectionParser.hpp" |
77 |
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//DirectionalAtomTypesSectionParser and AtomTypesSectionParser. The order |
78 |
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//of BondTypesSectionParser, BendTypesSectionParser and |
79 |
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//TorsionTypesSectionParser are not important. |
80 |
< |
|
80 |
> |
spMan_.push_back(new OptionSectionParser(forceFieldOptions_)); |
81 |
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spMan_.push_back(new ShapeAtomTypesSectionParser()); |
82 |
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spMan_.push_back(new DirectionalAtomTypesSectionParser()); |
83 |
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spMan_.push_back(new AtomTypesSectionParser()); |
84 |
< |
spMan_.push_back(new LennardJonesAtomTypesSectionParser()); |
84 |
> |
spMan_.push_back(new LennardJonesAtomTypesSectionParser(forceFieldOptions_)); |
85 |
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spMan_.push_back(new ChargeAtomTypesSectionParser()); |
86 |
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spMan_.push_back(new MultipoleAtomTypesSectionParser()); |
87 |
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spMan_.push_back(new StickyAtomTypesSectionParser()); |