| _version_ | 1866901611598577664 |
|---|---|
| author | Curry, Joshua D. |
| author_facet | Curry, Joshua D. |
| contents | A computational pipeline for identifying CNS-penetrant small molecule modulators of TIMP2 through large-scale virtual screening, ADMET profiling, and orthogonal toxicity validation. Includes Python scripts, ligand libraries, docking results, and filtering tools. |
| format | Recurso digital |
| id | zenodo_https___doi_org_10_5281_zenodo_17555741 |
| institution | Zenodo |
| language | |
| publishDate | 2025 |
| publisher | Zenodo |
| record_format | zenodo |
| spellingShingle | TIMP2 Docking and ADMET Pipeline Curry, Joshua D. TIMP2 Neuroplasticity Virtual Screening AutoDock Vina ADMET ProTox-III Python CNS Drug Discovery A computational pipeline for identifying CNS-penetrant small molecule modulators of TIMP2 through large-scale virtual screening, ADMET profiling, and orthogonal toxicity validation. Includes Python scripts, ligand libraries, docking results, and filtering tools. |
| title | TIMP2 Docking and ADMET Pipeline |
| topic | TIMP2 Neuroplasticity Virtual Screening AutoDock Vina ADMET ProTox-III Python CNS Drug Discovery |
| url | https://doi.org/10.5281/zenodo.17555741 |