# # ChangeLog for tests/regression/Potential/FitFragmentPartialCharges/pre # # Generated by Trac 1.4.4 # Apr 9, 2025, 4:56:57 AM Fri, 24 Mar 2017 10:12:21 GMT Frederik Heber [2f9faf] * doc/userguide/userguide.xml (modified) * src/Actions/GlobalListOfActions.hpp (modified) * src/Actions/Makefile.am (modified) * src/Actions/PotentialAction/FitFragmentPartialChargesAction.cpp (added) * src/Actions/PotentialAction/FitFragmentPartialChargesAction.def (added) * src/Actions/PotentialAction/FitFragmentPartialChargesAction.hpp (added) * src/Actions/PotentialAction/FitPartialChargesAction.cpp (modified) * tests/regression/Makefile.am (modified) * tests/regression/Potential/FitFragmentPartialCharges/post/water.particles (added) * tests/regression/Potential/FitFragmentPartialCharges/pre/atomfragments.dat (added) * tests/regression/Potential/FitFragmentPartialCharges/pre/results_grid.dat (added) * tests/regression/Potential/FitFragmentPartialCharges/pre/water.pdb (added) * tests/regression/Potential/FitFragmentPartialCharges/testsuite-potential-fit-fragment-partial-charges.at (added) * tests/regression/Potential/testsuite-potential.at (modified) Added FitFragmentPartialChargesAction that fits partial charges to ...