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(edit) @5169d1b   19 minutes frederik.heber Set version to 1.7.1. - MoleCuilder library is now 19:1:0. - Codename … Candidate_v1.7.1 stable v1.7.1
(edit) @56496c   19 minutes frederik.heber FIX: Small log change in GLWorldScene. Candidate_v1.7.1 stable
(edit) @c742bb1   19 minutes frederik.heber Removes some Observer::signOn's from GLWorldView. - since the … Candidate_v1.7.1 stable
(edit) @033646   19 minutes frederik.heber FIX: Insecure access in GLWorldScene on reparenting. - We … Candidate_v1.7.1 stable
(edit) @c8cb0d   19 minutes frederik.heber Streamlines channel creation in Observables. - CodePatterns is now … Candidate_v1.7.1 stable
(edit) @f2d5ce   19 minutes frederik.heber QtTimeLine no longers queries WorldTime directly. - This was slightly … Candidate_v1.7.1 stable
(edit) @bdd1d0   19 minutes frederik.heber FIX: GeneratePotentials action also accepts empty potential list. - … Candidate_v1.7.1 stable
(edit) @f0234e   19 minutes frederik.heber FIX: StoreSession action ignores unset parameters. - those parameters … Candidate_v1.7.1 stable
(edit) @4538c0   19 minutes frederik.heber Recreated guicheck from regression tests. Candidate_v1.7.1 stable
(edit) @47ebb2   19 minutes frederik.heber TESTFIX: Fragmentation tests lacked load bondtable. Candidate_v1.7.1 stable
(edit) @2e7888   21 minutes frederik.heber Adds computed bond table. - The bond table is complete for all … Candidate_v1.7.1 stable
(edit) @802a9d   5 days frederik.heber Adds scripts to generate a bond table. - one python script for the … Candidate_v1.7.1 stable
(edit) @e4b9d5   5 days frederik.heber Adds python command getSelectedAtomCount(). - this avoids needing to … Candidate_v1.7.1 stable
(edit) @bc58f2   5 days frederik.heber FIX: SaturatedFragment saturated despite other option. - when no or … Candidate_v1.7.1 stable
(edit) @dce5a3   5 days frederik.heber Adds AddSelectedAtomsAsFragmentAction. - this action allows … Candidate_v1.7.1 stable
(edit) @44d5d9   7 days frederik.heber FIX: TremoloParser triggered changes too often. - when parsing a file … Candidate_v1.7.1 stable
(edit) @98ad30   7 days frederik.heber QtView: SingleShort timer fires every 10ms. - moreover, we only fire … Candidate_v1.7.1 stable
(edit) @25aa214   7 days frederik.heber FIX: fragmentation hydrogens do not trigger AtomInserted. - we had … Candidate_v1.7.1 stable
(edit) @d2be22   7 days frederik.heber Actions relying on BondGraph fail if not bond table is loaded. - this … Candidate_v1.7.1 stable
(edit) @29ba9a   7 days frederik.heber FIX: QtObservedAtom avoids using atomRef on first subjectKilled. Candidate_v1.7.1 stable
(edit) @37d1c3   7 days frederik.heber Molecules in tesselated view can now be clicked and selected. Candidate_v1.7.1 stable
(edit) @57608e   7 days frederik.heber Attempt to simplify redraw event in Qt View. Candidate_v1.7.1 stable
(edit) @4e124d   6 weeks frederik.heber FIX: Changes key for switching showpicking on/off. - Prior tab … Candidate_v1.7.1 stable
(edit) @8b9357   6 weeks frederik.heber Adds utility for visualizing signal-slot graphs. - this is directly … Candidate_v1.7.1 stable
(edit) @f41a18   6 weeks frederik.heber GLMoleculeObject_atom simply draw all children. - force and velocity … Candidate_v1.7.1 stable
(edit) @c0e35d   6 weeks frederik.heber FIX: a hover end causes a signal to updateGL. Candidate_v1.7.1 stable
(edit) @b6f2d2   8 weeks frederik.heber DOC: Updates the qtgui part of the userguide. - adds table with … Candidate_v1.7.1 stable
(edit) @a2c7c3   8 weeks frederik.heber Right-click context menu depends on selection mode. - if atoms are … Candidate_v1.7.1 stable
(edit) @49719b   8 weeks frederik.heber Sets correct copyright header in molecuilder. Candidate_v1.7.1 stable
(edit) @71423c   8 weeks frederik.heber FIX: Context menu destroyed hover functionality. - The right click … Candidate_v1.7.1 stable
(edit) @511f02   8 weeks frederik.heber FIX: Fixed relaying events in derived Qt classes. - we always need to … Candidate_v1.7.1 stable
(edit) @33f34f   8 weeks frederik.heber FIX: Readds package check for qt packages. - This is needed for … Candidate_v1.7.1 stable
(edit) @13e5be   2 months frederik.heber Set version to 1.7.0. - MoleCuilder library is now 19:0:0. - Codename … Candidate_v1.7.1 stable v1.7.0
(edit) @91c409   2 months frederik.heber TESTFIX: Fixes integration jobs. - also changes to due new k8s setup … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @15678e   3 months frederik.heber TESTFIX: mpqc-jobs fixed with new k8s working mode. - we forgot to … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @c012a1   3 months frederik.heber FIX: Boxmaker.py converted to python3. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @26cfa51   3 months frederik.heber FIX: Adds missing default options to options.dat. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @70975a   3 months frederik.heber FIX: Graph6ReaderUnitTest had wrong graph6 string. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @bd4732   3 months frederik.heber VMG: LibraryForceSinus(Unit)Test crash. - removed those tests for now. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @e9f307   3 months frederik.heber MPQC_OPEN: fix validation testsuite after output muting. - our muting … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9259c3   3 months frederik.heber MPQC_OPEN: Fixes unit tests. - several unit tests programs actually … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9f1c84   3 months frederik.heber VMG: OMPI 2.1.1 has issues on writing files in parallel. - for this … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5d18f3   3 months frederik.heber FIX: PotentialTrainer did not heed take-best correctly. - we used the … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5b8c49   3 months frederik.heber FIX: fixes QtPotentialList not getting notified about … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @6762b2   3 months frederik.heber FIX: CodePattern's Registry has virtual (un)register functions. - we … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @85dd16   3 months frederik.heber Adds new tab "All potentials". - tab lists all potentials from … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @a4b917   3 months frederik.heber Adds add and remove potential actions. - DOC: Adds missing actions to … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @a0d8aa   4 months frederik.heber PotentialFactory exposes particle type numbers. - Also, potentials … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @e83114   4 months frederik.heber StreamFactory_EmpiricalPotential creates potential instances with … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @72b6d7   4 months frederik.heber SerializablePotential's parameters_t is taken from FunctionModel. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5a255af   4 months frederik.heber FIX: deserialized EmpiricalPotential lacked parameters. - with the … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @476781   4 months frederik.heber FIX: fixes several issues in QtHomologyList related to plotting. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @d56114   4 months frederik.heber TESTFIX: very tiny changes in VerletIntegration. - Changes in the … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @454d7a   4 months frederik.heber TESTFIX: adapts regression test on changed temperature units. - This … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @a93896   4 months frederik.heber Ignores pyMoleCuilder import in python script. - TEST: LoadSession … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9928ece   4 months frederik.heber DOCFIX: fixes wrong linkends for potentials. - also changes the main … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @dfe653   4 months frederik.heber TESTFIX: Finalizes evaluate stability regression test. - recomputed … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @d25515   4 months frederik.heber TESTFIX: Finalizes pair correlation agains element regression test … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @f5e28b   5 months frederik.heber TESTFIX: Fixes graph6 string printing regression test case. - This … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @400ee4   5 months frederik.heber TESTFIX: finalizes regression test cases for atom neighbor selection. … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9175c8   5 months frederik.heber TESTFIX: select random number of atoms test cases finalized. - the … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @1e6591   5 months frederik.heber FIX: Saturating nitrogen produces very slight changed coordinates. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @463bfb   5 months frederik.heber FIX: SaturateAction had typo in default. - this originated in 2390e63956. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @780bfa   5 months frederik.heber FIX: FormatParserStorage did not add parser instance on SetOutput. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @bcc29ca   5 months frederik.heber Splits off Undo mark actions. - Undo action has again no parameters … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @1c355bf   5 months frederik.heber Increases image size of present icons. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @e0feb3   5 months frederik.heber Increases size of icons in toolbar. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5718cc   5 months frederik.heber Ignoring VScode stuff. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9cdab3   5 months frederik.heber Adds context menu "atom" to GLWorldView. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @ae9ad6   5 months frederik.heber Removes check in FragmentationAutomation's ReceiveResults. - we can … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @ab2e834   5 months frederik.heber Reduces JobMarket features for use in kubernetes clusters. - removes … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @aeec58   5 months frederik.heber JobMarket: added worker's ServerPing. - the worker needs to check … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @e2f31d3   5 months frederik.heber JobMarket: PoolGuard checks also all other (idle) workers. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @2c3ae5   5 months frederik.heber JobMarket: Extended PoolGuard to also check idle workers. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @74d798   5 months frederik.heber JobMarket: Scheduler shutdown in extra thread. - The shutdown needs … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @950cd4   5 months frederik.heber Added HealthProbeListener to PoolWorker. - this allows a simple tcp … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @e5f9e7   5 months frederik.heber Adds k8s files for running poolworker and server. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5e0f64   5 months frederik.heber Added dockerfile to repository and how to build it. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @454b555   5 months frederik.heber Improved includes for Qt classes. - QT_CFLAGS needs to be set in … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @ce666c   5 months frederik.heber Adds double/triple H bond distance and angle for S, P. - these are … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @641550   5 months frederik.heber FIX: Fixes GetBondLength off-by-one. - in ad09292f6 we overlooked … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @c41ce0   5 months frederik.heber Adds qt_size and qt_position arguments to control Qt window size. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @6294b6   5 months frederik.heber MPQCJob mutes output on verbosity level 0 and unmutes else. - we … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @c099dc   5 months frederik.heber SetParserParameters prints old and new params. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @19832d   22 months frederik.heber BondGraph: returns 1. instead of -1. on miss. - when the symmetric … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9782e20   22 months frederik.heber BondifyAction: added undo/redo. - DOC: fixed small typo in Action's … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @ad0929   22 months frederik.heber FIX: BondGraph::GetBondLength() accessed off by one. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @02f14d   22 months frederik.heber Adapting python regression tests to python3. - AT_TESTED cannot … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @399c69   22 months frederik.heber Rewrote AddAction to use UndoRedoHelpers. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @0427d1   22 months frederik.heber FIX: ActionQueue no locked on CurrentAction access. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @d203d1e   2 years frederik.heber FIX: generated icons in data nodist when no Qt. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @5a479d   2 years frederik.heber Added python actions to generate all graph6 strings. - graph6 strings … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @d083cc   2 years frederik.heber Python3: Test/Python changed. - print -> print() Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @6dde30   2 years frederik.heber Copying updates boost over to CodePatterns, JobMarket. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @44ce58   2 years frederik.heber FIX: solves xcb issues under ubuntu 22.04. - under Ubuntu 22.04 (with … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @9a992a   3 years frederik.heber Removed -lpython3.8 from boost.m4. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @1b84b8   3 years frederik.heber FIX: icons.qrc missing in dist file when compiled without qt. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @f91f47   3 years frederik.heber FIX: JobMarket's PoolGuard did not check for existing result. - when … Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @75a0cb   3 years frederik.heber Adding gcc 7.5 to boost.m4. Candidate_v1.7.0 Candidate_v1.7.1 stable
(edit) @c53ae2   3 years frederik.heber FIX: WorkerListener tried to get result from new-joined worker. - … Candidate_v1.7.0 Candidate_v1.7.1 stable
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