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Backport to support GROMACS 2026 - MDAnalysis TPRParser rejects tpx 138, blocking Boresch restraint generation
documentationImprovements or additions to documentationImprovements or additions to documentationenhancementNew feature or requestNew feature or requestfeature requestFeature requested by usersFeature requested by usersStatus: Open.#53 In ale94mleon/BindFlow;Extend water and ion models
enhancementNew feature or requestNew feature or requestStatus: Open.#51 In ale94mleon/BindFlow;Update barostat
enhancementNew feature or requestNew feature or requestStatus: Open.#49 In ale94mleon/BindFlow;Protein Protein Interaction Support
documentationImprovements or additions to documentationImprovements or additions to documentationfeature requestFeature requested by usersFeature requested by usersStatus: Open.#42 In ale94mleon/BindFlow;Implementation of alchemical ion
enhancementNew feature or requestNew feature or requestStatus: Open.Improve solvation phase
enhancementNew feature or requestNew feature or requestStatus: Open.#40 In ale94mleon/BindFlow;Boost preparation phase
enhancementNew feature or requestNew feature or requestStatus: Open.#38 In ale94mleon/BindFlow;Add explicit water to MMGBSA calculation
enhancementNew feature or requestNew feature or requestStatus: Open.#35 In ale94mleon/BindFlow;Raise an error if cofactor is giving but there is not residue called COF
bugSomething isn't workingSomething isn't workingStatus: Open.#34 In ale94mleon/BindFlow;Improve host/ligand_name/selection
enhancementNew feature or requestNew feature or requestStatus: Open.#32 In ale94mleon/BindFlow;Add dynamic restraint on equilibration for soluble complex
enhancementNew feature or requestNew feature or requestStatus: Open.#8 In ale94mleon/BindFlow;Add check of LIG flexibility
enhancementNew feature or requestNew feature or requestStatus: Open.#6 In ale94mleon/BindFlow;