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Un-constrain Pint in tests

Status: Open.

#745 In openforcefield/openff-evaluator;

* mattwthompson opened on Mar 3, 2026

Update test environment

Status: Open.

#744 In openforcefield/openff-evaluator;

* mattwthompson opened on Mar 3, 2026

A filter that grabs all dhmix data, then selects other (e.g. density) data with the same compounds, then fills out more density data as needed

Status: Open.

#738 In openforcefield/openff-evaluator;

* lilyminium opened on Feb 23, 2026

Can't re-fit virtual sites due to inability to identify them uniquely

Status: Open.

#726 In openforcefield/openff-evaluator;

* lilyminium opened on Feb 6, 2026

Cannot use FilterBySmilesSchema in a CurationWorkflow

Status: Open.

#722 In openforcefield/openff-evaluator;

* lilyminium opened on Feb 1, 2026

Tutorial 04 - Optimizing Force Fields Using Partial Charges

Status: Open.

#715 In openforcefield/openff-evaluator;

* faranaknejat1991-bot opened on Dec 6, 2025

Look into uncertainties warning

Status: Open.

#709 In openforcefield/openff-evaluator;

* mattwthompson opened on Oct 10, 2025

Use openff.toolkit.Topology JSON files instead of PDB files

Status: Open.

#708 In openforcefield/openff-evaluator;

* mattwthompson opened on Oct 9, 2025

Improve speed of filtering

Status: Open.

#704 In openforcefield/openff-evaluator;

* mattwthompson opened on Oct 3, 2025

Packmol wrapper chokes on amino acids because of MDTraj-written PDB files

Status: Open.

#699 In openforcefield/openff-evaluator;

* lilyminium opened on Sep 25, 2025

When equilibrated data is not provided in stored_data to a PreequilibratedSimulation workflow, it triggers error "A protocol with the same id already exists in this workflow"

Status: Open.

#698 In openforcefield/openff-evaluator;

* lilyminium opened on Sep 10, 2025

ComputeDipoleMoments._compute_charge_derivatives incorrectly expects OpenMM units from system_subset

Status: Open.

#696 In openforcefield/openff-evaluator;

* Shahriar-Keshvari opened on Aug 31, 2025