Add_FitFragmentPartialChargesAction
Fix_ChargeSampling_PBC
Fix_FitPartialCharges
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| 1 | /*
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| 2 | * AtomIdDescriptor.hpp
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| 3 | *
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| 4 | * Created on: Feb 5, 2010
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| 5 | * Author: crueger
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| 6 | */
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| 7 |
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| 8 | #ifndef ATOMIDDESCRIPTOR_HPP_
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| 9 | #define ATOMIDDESCRIPTOR_HPP_
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| 10 |
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| 11 | // include config.h
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| 12 | #ifdef HAVE_CONFIG_H
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| 13 | #include <config.h>
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| 14 | #endif
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| 15 |
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| 16 |
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| 17 | #include "types.hpp"
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| 18 | #include "Descriptors/AtomDescriptor.hpp"
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| 19 |
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| 20 | AtomDescriptor AtomById(atomId_t id);
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| 21 |
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| 22 | #endif /* ATOMIDDESCRIPTOR_HPP_ */
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