Searched refs:bnd_ctype (Results 1 – 2 of 2) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | topology_connectivity_util.F | 389 inter_bonds = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
426 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
470 DEALLOCATE (bnd_ctype)
553 inter_bends = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
592 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
707 inter_ubs = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
742 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
867 inter_torsions = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
909 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
1046 inter_imprs = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
[all …]
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | topology_connectivity_util.F | 389 inter_bonds = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
426 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
470 DEALLOCATE (bnd_ctype)
553 inter_bends = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
592 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
707 inter_ubs = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
742 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
867 inter_torsions = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
909 DO j = bnd_ctype(1, i), bnd_ctype(2, i)
1046 inter_imprs = bnd_ctype(2, i) - bnd_ctype(1, i) + 1
[all …]
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