{"library":"propka","type":"library","category":null,"description":"PROPKA 3 is a Python library and command-line tool for predicting the pKa values of ionizable groups in proteins and protein-ligand complexes based on their 3D structure. It is actively maintained by the Jensen Group, with regular updates addressing bug fixes, performance improvements, and new features. The current version is 3.5.1.","language":"python","status":"active","version":"3.5.1","tags":["pKa prediction","protein","ligand","computational chemistry","biophysics","molecular modeling"],"install":[{"cmd":"pip install propka","imports":["from propka import run","import propka"]}],"homepage":"http://propka.org","github":null,"docs":null,"changelog":null,"pypi":"https://pypi.org/project/propka/","npm":null,"openapi_spec":null,"status_page":null,"smithery":null,"compatibility":{"summary":{"python_range":"3.10–3.9","success_rate":100,"avg_install_s":1.6,"avg_import_s":0.13,"wheel_type":"wheel"},"url":"https://checklist.day/v1/registry/propka/compatibility"},"provenance":{"verified_status":"passing","verified_at":"Sun Jun 28","last_verified":"Sun Jun 28","next_check":"Tue Jul 28","install_tag":null}}