{"id":19423080,"url":"https://github.com/quantori/scip-vina","last_synced_at":"2026-06-13T03:32:23.635Z","repository":{"id":105048009,"uuid":"579992586","full_name":"quantori/scip-vina","owner":"quantori","description":"AutoDock Vina is one of the fastest and most widely used open-source docking engines. It is based on a simple scoring function and rapid gradient-optimization conformational search. It was originally designed and implemented by Dr. Oleg Trott in the Molecular Graphics Lab. This fork of Vina adds changes that allow it to be a part of DockingFactory.","archived":false,"fork":false,"pushed_at":"2022-12-31T11:27:27.000Z","size":108,"stargazers_count":0,"open_issues_count":0,"forks_count":0,"subscribers_count":2,"default_branch":"main","last_synced_at":"2025-01-07T18:52:02.959Z","etag":null,"topics":["docking","drug-discovery","molecular-docking","virtual-screening"],"latest_commit_sha":null,"homepage":"","language":"C++","has_issues":true,"has_wiki":null,"has_pages":null,"mirror_url":null,"source_name":null,"license":"apache-2.0","status":null,"scm":"git","pull_requests_enabled":true,"icon_url":"https://github.com/quantori.png","metadata":{"files":{"readme":"README.md","changelog":null,"contributing":null,"funding":null,"license":"LICENSE","code_of_conduct":null,"threat_model":null,"audit":null,"citation":null,"codeowners":null,"security":null,"support":null,"governance":null,"roadmap":null,"authors":null,"dei":null,"publiccode":null,"codemeta":null}},"created_at":"2022-12-19T13:02:41.000Z","updated_at":"2023-01-05T07:23:04.000Z","dependencies_parsed_at":null,"dependency_job_id":"200dbeab-9cc8-4291-bf27-749cdf3f096d","html_url":"https://github.com/quantori/scip-vina","commit_stats":null,"previous_names":[],"tags_count":0,"template":false,"template_full_name":null,"repository_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/quantori%2Fscip-vina","tags_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/quantori%2Fscip-vina/tags","releases_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/quantori%2Fscip-vina/releases","manifests_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/quantori%2Fscip-vina/manifests","owner_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/owners/quantori","download_url":"https://codeload.github.com/quantori/scip-vina/tar.gz/refs/heads/main","host":{"name":"GitHub","url":"https://github.com","kind":"github","repositories_count":240602741,"owners_count":19827572,"icon_url":"https://github.com/github.png","version":null,"created_at":"2022-05-30T11:31:42.601Z","updated_at":"2022-07-04T15:15:14.044Z","host_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub","repositories_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories","repository_names_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/repository_names","owners_url":"https://repos.ecosyste.ms/api/v1/hosts/GitHub/owners"}},"keywords":["docking","drug-discovery","molecular-docking","virtual-screening"],"created_at":"2024-11-10T13:36:36.851Z","updated_at":"2026-06-13T03:32:18.609Z","avatar_url":"https://github.com/quantori.png","language":"C++","funding_links":[],"categories":[],"sub_categories":[],"readme":"# AutoDock Vina\n\nAutoDock Vina is one of the fastest and most widely used open-source docking engines. It is a turnkey computational docking program that is based on a simple scoring function and rapid gradient-optimization conformational search. It was originally designed and implemented by Dr. Oleg Trott in the Molecular Graphics Lab.\n\n## Bundle\n\nThis fork of AutoDock Vina adds changes that allow it to run as a part of Quantori DockingFactory. The head project of DockingFactory is [DockingFactory Bundle](https://github.com/quantori/scip-dockingfactory-bundle). Other projects that are also parts of the bundle are:\n- [DockingFactory](https://github.com/quantori/scip-dockingfactory)\n- [DockingInterface](https://github.com/quantori/scip-dockinginterface)\n- [Smina](https://github.com/quantori/scip-smina)\n- [QVina 2](https://github.com/quantori/scip-qvina)\n- [rDock](https://github.com/quantori/scip-rdock)\n\n## License\n\nAutodock Vina is released under [Apache License, Version 2.0](LICENSE)\n","project_url":"https://awesome.ecosyste.ms/api/v1/projects/github.com%2Fquantori%2Fscip-vina","html_url":"https://awesome.ecosyste.ms/projects/github.com%2Fquantori%2Fscip-vina","lists_url":"https://awesome.ecosyste.ms/api/v1/projects/github.com%2Fquantori%2Fscip-vina/lists"}