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mrbuchemrbuche
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jl done
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26 files changed

+4341
-667
lines changed

26 files changed

+4341
-667
lines changed

‎src/physics/single_chain/efjc/thermodynamics/test.jl‎

Lines changed: 24 additions & 12 deletions
Original file line numberDiff line numberDiff line change
@@ -293,7 +293,8 @@ end
293293
relative_helmholtz_free_energy_legendre -
294294
relative_helmholtz_free_energy_legendre_out
295295
residual_rel = residual_abs / relative_helmholtz_free_energy_legendre
296-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
296+
@test abs(residual_abs) <= parameters.abs_tol ||
297+
abs(residual_rel) <= parameters.rel_tol
297298
end
298299
end
299300

@@ -333,7 +334,8 @@ end
333334
relative_helmholtz_free_energy_per_link_legendre -
334335
relative_helmholtz_free_energy_per_link_legendre_out
335336
residual_rel = residual_abs / relative_helmholtz_free_energy_per_link_legendre
336-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
337+
@test abs(residual_abs) <= parameters.abs_tol ||
338+
abs(residual_rel) <= parameters.rel_tol
337339
end
338340
end
339341

@@ -486,7 +488,8 @@ end
486488
nondimensional_relative_helmholtz_free_energy_legendre -
487489
nondimensional_relative_helmholtz_free_energy_legendre_out
488490
residual_rel = residual_abs / nondimensional_relative_helmholtz_free_energy_legendre
489-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
491+
@test abs(residual_abs) <= parameters.abs_tol ||
492+
abs(residual_rel) <= parameters.rel_tol
490493
end
491494
end
492495

@@ -527,7 +530,8 @@ end
527530
nondimensional_relative_helmholtz_free_energy_per_link_legendre_out
528531
residual_rel =
529532
residual_abs / nondimensional_relative_helmholtz_free_energy_per_link_legendre
530-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
533+
@test abs(residual_abs) <= parameters.abs_tol ||
534+
abs(residual_rel) <= parameters.rel_tol
531535
end
532536
end
533537

@@ -738,7 +742,8 @@ end
738742
relative_helmholtz_free_energy_legendre -
739743
relative_helmholtz_free_energy_legendre_out
740744
residual_rel = residual_abs / relative_helmholtz_free_energy_legendre
741-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
745+
@test abs(residual_abs) <= parameters.abs_tol ||
746+
abs(residual_rel) <= parameters.rel_tol
742747
end
743748
end
744749

@@ -781,7 +786,8 @@ end
781786
relative_helmholtz_free_energy_per_link_legendre -
782787
relative_helmholtz_free_energy_per_link_legendre_out
783788
residual_rel = residual_abs / relative_helmholtz_free_energy_per_link_legendre
784-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
789+
@test abs(residual_abs) <= parameters.abs_tol ||
790+
abs(residual_rel) <= parameters.rel_tol
785791
end
786792
end
787793

@@ -934,7 +940,8 @@ end
934940
nondimensional_relative_helmholtz_free_energy_legendre -
935941
nondimensional_relative_helmholtz_free_energy_legendre_out
936942
residual_rel = residual_abs / nondimensional_relative_helmholtz_free_energy_legendre
937-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
943+
@test abs(residual_abs) <= parameters.abs_tol ||
944+
abs(residual_rel) <= parameters.rel_tol
938945
end
939946
end
940947

@@ -975,7 +982,8 @@ end
975982
nondimensional_relative_helmholtz_free_energy_per_link_legendre_out
976983
residual_rel =
977984
residual_abs / nondimensional_relative_helmholtz_free_energy_per_link_legendre
978-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
985+
@test abs(residual_abs) <= parameters.abs_tol ||
986+
abs(residual_rel) <= parameters.rel_tol
979987
end
980988
end
981989

@@ -1184,7 +1192,8 @@ end
11841192
relative_helmholtz_free_energy_legendre -
11851193
relative_helmholtz_free_energy_legendre_out
11861194
residual_rel = residual_abs / relative_helmholtz_free_energy_legendre
1187-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
1195+
@test abs(residual_abs) <= parameters.abs_tol ||
1196+
abs(residual_rel) <= parameters.rel_tol
11881197
end
11891198
end
11901199

@@ -1227,7 +1236,8 @@ end
12271236
relative_helmholtz_free_energy_per_link_legendre -
12281237
relative_helmholtz_free_energy_per_link_legendre_out
12291238
residual_rel = residual_abs / relative_helmholtz_free_energy_per_link_legendre
1230-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
1239+
@test abs(residual_abs) <= parameters.abs_tol ||
1240+
abs(residual_rel) <= parameters.rel_tol
12311241
end
12321242
end
12331243

@@ -1380,7 +1390,8 @@ end
13801390
nondimensional_relative_helmholtz_free_energy_legendre -
13811391
nondimensional_relative_helmholtz_free_energy_legendre_out
13821392
residual_rel = residual_abs / nondimensional_relative_helmholtz_free_energy_legendre
1383-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
1393+
@test abs(residual_abs) <= parameters.abs_tol ||
1394+
abs(residual_rel) <= parameters.rel_tol
13841395
end
13851396
end
13861397

@@ -1421,7 +1432,8 @@ end
14211432
nondimensional_relative_helmholtz_free_energy_per_link_legendre_out
14221433
residual_rel =
14231434
residual_abs / nondimensional_relative_helmholtz_free_energy_per_link_legendre
1424-
@test abs(residual_abs) <= parameters.abs_tol || abs(residual_rel) <= parameters.rel_tol
1435+
@test abs(residual_abs) <= parameters.abs_tol ||
1436+
abs(residual_rel) <= parameters.rel_tol
14251437
end
14261438
end
14271439

‎src/physics/single_chain/swfjc/thermodynamics/test.jl‎

Lines changed: 8 additions & 4 deletions
Original file line numberDiff line numberDiff line change
@@ -256,7 +256,8 @@ end
256256
relative_helmholtz_free_energy_legendre -
257257
relative_helmholtz_free_energy_legendre_out
258258
residual_rel = residual_abs / relative_helmholtz_free_energy_legendre
259-
@test abs(residual_abs) <= 3e1 * parameters.abs_tol || abs(residual_rel) <= 3e1 * parameters.rel_tol
259+
@test abs(residual_abs) <= 3e1 * parameters.abs_tol ||
260+
abs(residual_rel) <= 3e1 * parameters.rel_tol
260261
end
261262
end
262263

@@ -292,7 +293,8 @@ end
292293
relative_helmholtz_free_energy_per_link_legendre -
293294
relative_helmholtz_free_energy_per_link_legendre_out
294295
residual_rel = residual_abs / relative_helmholtz_free_energy_per_link_legendre
295-
@test abs(residual_abs) <= 3e1 * parameters.abs_tol || abs(residual_rel) <= 3e1 * parameters.rel_tol
296+
@test abs(residual_abs) <= 3e1 * parameters.abs_tol ||
297+
abs(residual_rel) <= 3e1 * parameters.rel_tol
296298
end
297299
end
298300

@@ -415,7 +417,8 @@ end
415417
nondimensional_relative_helmholtz_free_energy_legendre -
416418
nondimensional_relative_helmholtz_free_energy_legendre_out
417419
residual_rel = residual_abs / nondimensional_relative_helmholtz_free_energy_legendre
418-
@test abs(residual_abs) <= 3e1 * parameters.abs_tol || abs(residual_rel) <= 3e1 * parameters.rel_tol
420+
@test abs(residual_abs) <= 3e1 * parameters.abs_tol ||
421+
abs(residual_rel) <= 3e1 * parameters.rel_tol
419422
end
420423
end
421424

@@ -450,7 +453,8 @@ end
450453
nondimensional_relative_helmholtz_free_energy_per_link_legendre_out
451454
residual_rel =
452455
residual_abs / nondimensional_relative_helmholtz_free_energy_per_link_legendre
453-
@test abs(residual_abs) <= 3e1 * parameters.abs_tol || abs(residual_rel) <= 3e1 * parameters.rel_tol
456+
@test abs(residual_abs) <= 3e1 * parameters.abs_tol ||
457+
abs(residual_rel) <= 3e1 * parameters.rel_tol
454458
end
455459
end
456460

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