-
Notifications
You must be signed in to change notification settings - Fork 64
All issues
Issue creation is restricted in this repository
Issues
is:issue state:open
is:issue state:open
Search results
Add automated detection of CG base-pairs to dna-restraints.cns
enhancementImproving something in the codebaseImproving something in the codebasem|emrefemref moduleemref modulem|flexrefflexref moduleflexref modulem|mdrefmdref modulemdref modulem|mdscoringmdscoring modulemdscoring moduleStatus: Open.#1659 In haddocking/haddock3;CAPRI eval uses different atom sets for DNA in AA and CG mode
bugSomething isn't workingSomething isn't workingm|caprievalImprovements in caprieval moduleImprovements in caprieval moduleStatus: Open.#1658 In haddocking/haddock3;Undeterministic behaviour of the martinize function in topocg
bugSomething isn't workingSomething isn't workingm|topocgtopocg moduletopocg moduleStatus: Open.#1657 In haddocking/haddock3;autotoppar for ligand topo/param generation only works for isolated ligands
enhancementImproving something in the codebaseImproving something in the codebasem|topoaatopoaa moduletopoaa moduleStatus: Open.#1645 In haddocking/haddock3;Create a dnacan module to scan all DNA base-pair mutations at the interface of a complex
featureAdding something new to the codebaseAdding something new to the codebaseStatus: Open.#1634 In haddocking/haddock3;refactor modularity-breaking implementations
planned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsrefactoringcode improvements without functionality changescode improvements without functionality changesStatus: Open.#1530 In haddocking/haddock3;Add caching to store RMSD values
featureAdding something new to the codebaseAdding something new to the codebaseplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1528 In haddocking/haddock3;Allow handling of molecules with more than 99999 atoms
enhancementImproving something in the codebaseImproving something in the codebasem|topoaatopoaa moduletopoaa moduleplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1506 In haddocking/haddock3;Enable docking of membrane proteins embedded into a bilayer
featureAdding something new to the codebaseAdding something new to the codebaseplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1486 In haddocking/haddock3;Add support for custom alignment file in [caprieval]
featureAdding something new to the codebaseAdding something new to the codebasem|caprievalImprovements in caprieval moduleImprovements in caprieval moduleplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1410 In haddocking/haddock3;Add an option to restrain non-canonical NA pairs
CNSImprovements in the CNS engineImprovements in the CNS enginecommunityFeature requests / contribution / issues from usersFeature requests / contribution / issues from usersenhancementImproving something in the codebaseImproving something in the codebasem|emrefemref moduleemref modulem|flexrefflexref moduleflexref modulem|mdrefmdref modulemdref moduleplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1397 In haddocking/haddock3;Refactor
align_fullinlibnotebooksenhancementImproving something in the codebaseImproving something in the codebaseplanned-long-termIssues that will be eventually done, used to mark issues as TODO itemsIssues that will be eventually done, used to mark issues as TODO itemsStatus: Open.#1375 In haddocking/haddock3;