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Gromacs
2026.0-dev-20251109-f20ba35
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#include <gromacs/nbnxm/pairlist.h>
Packed j-cluster list.
Four j-cluster indices are stored per integer in an nbnxn_cj_packed_t.
Public Member Functions | |
| PackedJClusterList (const PinningPolicy pinningPolicy) | |
| int | cj (const int index) const |
Return the j-cluster index for index from the pack list. | |
| unsigned int | imask0 (const int index) const |
Return the i-cluster interaction mask for the first cluster in index. | |
| Index | size () const noexcept |
| Return the size of the list (not the number of packed elements) | |
| bool | empty () const noexcept |
| Return whether the list is empty. | |
| void | resize (Index count) |
| Resize the packed list. | |
| void | push_back (const decltype(list_)::value_type &value) |
| Add a new element to the packed list. | |
1.8.5