35 |
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* |
36 |
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* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
37 |
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* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
38 |
< |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
38 |
> |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). |
39 |
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* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
40 |
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* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
41 |
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*/ |
48 |
|
/** Register all integrators*/ |
49 |
|
void registerIntegrators(); |
50 |
|
|
51 |
< |
/** Register all minimizers*/ |
52 |
< |
void registerMinimizers(); |
51 |
> |
/** Register all optimizers */ |
52 |
> |
void registerOptimizers(); |
53 |
|
|
54 |
|
/** Register all lattice */ |
55 |
|
void registerLattice(); |
56 |
|
|
57 |
< |
/** register force fields, integrators and minmizers*/ |
57 |
> |
/** register force fields, integrators and optimizers */ |
58 |
|
void registerAll(); |
59 |
|
|
60 |
|
} |