# | Line 30 | Line 30 | SimInfo::SimInfo(){ | |
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30 | n_dipoles = 0; | |
31 | ndf = 0; | |
32 | ndfRaw = 0; | |
33 | + | nZconstraints = 0; |
34 | the_integrator = NULL; | |
35 | setTemp = 0; | |
36 | thermalTime = 0.0; | |
37 | currentTime = 0.0; | |
38 | rCut = 0.0; | |
39 | + | origRcut = -1.0; |
40 | ecr = 0.0; | |
41 | + | origEcr = -1.0; |
42 | est = 0.0; | |
43 | oldEcr = 0.0; | |
44 | oldRcut = 0.0; | |
# | Line 362 | Line 365 | int SimInfo::getNDF(){ | |
365 | ndf = ndf_local; | |
366 | #endif | |
367 | ||
368 | < | ndf = ndf - 3; |
368 | > | ndf = ndf - 3 - nZconstraints; |
369 | ||
370 | return ndf; | |
371 | } |
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