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Custom Charge

Status: Open.

#156 In CBDD/rDock;

· Jotaro1004 opened on Dec 8, 2025

[PoC] Implement streaming operations for rdock utils

Status: Open.

#155 In CBDD/rDock;

· ggutierrez-sunbright opened on Nov 8, 2025

Fix deprecation warnings

quality

upgradea design modification, refactor, or component replacementa design modification, refactor, or component replacement

Status: Open.

Task

#153 In CBDD/rDock;

· ggutierrez-sunbright opened on Apr 16, 2025

Improve TRIPOS atom type parsing

enhancementNew feature or requestNew feature or request

quality

upgradea design modification, refactor, or component replacementa design modification, refactor, or component replacement

Status: Open.

#152 In CBDD/rDock;

· ggutierrez-sunbright opened on Apr 6, 2025

Create additional integration tests for rbcavity and rbdock

CI/CD

testing

Status: Open.

#146 In CBDD/rDock;

· ggutierrez-sunbright opened on Feb 12, 2025

Upgrade to clang-format 20

CI/CD

quality

upgradea design modification, refactor, or component replacementa design modification, refactor, or component replacement

Status: Open.

Task

#145 In CBDD/rDock;

· ggutierrez-sunbright opened on Feb 3, 2025

Issue: Discrepancy in Scoring Function when Docking with HOH in rDock

supportusers asking for help or information about the projectusers asking for help or information about the project

Status: Open.

#123 In CBDD/rDock;

· Arthurcarre opened on Jun 17, 2024

Question: Expected behaviour of scoring function parameter overrides in docking protocol parameter file.

Status: Open.

#118 In CBDD/rDock;

· Beetelbrox opened on Jun 6, 2024

Check possible bug for file reading

bugSomething isn't workingSomething isn't working

Status: Open.

#113 In CBDD/rDock;

· ggutierrez-sunbright opened on May 5, 2024

upgrade to cxxopts in rbdock

upgradea design modification, refactor, or component replacementa design modification, refactor, or component replacement

Status: Open.

#111 In CBDD/rDock;

· ggutierrez-sunbright opened on May 3, 2024

·  

libpopt removal

Standardize behaviors and designs in rdock-utils

rdock-utils

Status: Open.

#110 In CBDD/rDock;

· ggutierrez-sunbright opened on May 3, 2024

·  

rdock-utils migration

refactor rbhtfinder

rdock-utils

upgradea design modification, refactor, or component replacementa design modification, refactor, or component replacement

Status: Open.

#107 In CBDD/rDock;

· ggutierrez-sunbright opened on Apr 25, 2024

·  

rdock-utils migration