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af5fc7ce

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Commit af5fc7ce authored 8 years ago by Gareth Tribello

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Added multicolvar actions to calculate the angles/torsions between bonds and the cell axes

parent c02f3ea0

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regtest/multicolvar/rt-axis-angles/Makefile 1 addition, 0 deletions

regtest/multicolvar/rt-axis-angles/Makefile
regtest/multicolvar/rt-axis-angles/colvar.reference 6 additions, 0 deletions

regtest/multicolvar/rt-axis-angles/colvar.reference
regtest/multicolvar/rt-axis-angles/config 4 additions, 0 deletions

regtest/multicolvar/rt-axis-angles/config
regtest/multicolvar/rt-axis-angles/deriv.reference 106 additions, 0 deletions

regtest/multicolvar/rt-axis-angles/deriv.reference
regtest/multicolvar/rt-axis-angles/plumed.dat 7 additions, 0 deletions

regtest/multicolvar/rt-axis-angles/plumed.dat
src/multicolvar/XAngle.cpp 170 additions, 0 deletions

src/multicolvar/XAngle.cpp
src/multicolvar/XYTorsion.cpp 226 additions, 0 deletions

src/multicolvar/XYTorsion.cpp

with 520 additions and 0 deletions

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