NCBI PubMed Central
open access
In silico discovery of CETP inhibitors from ZINC15 compounds using docking, ADMET filtering, and molecular dynamics simulations.
Conceptio Open Archive
Analyze & explore related research in Conceptio
Connect this record directly into your research workflow or AI agent. Explore citations across open repositories, query full text, and export structured proof bundles.
This document is indexed with metadata only: full text is not available in the archive for this record. Open the official source ↗
Related documents
- In Silico Identification of Natural-Product Aromatase (CYP19A1) Inhibitors via Integrated Molecular Docking and QSAR Modelling.#636344
- Structure-based virtual screening for selective connexin hemichannel blockers: a historical perspective on the discovery of a small organic inhibitor.#358390
- Exploring benzofuran derivatives as selective MAO-B inhibitors: a multilayered in silico study#1082873
- In silico profiling, molecular docking, and RMSD prediction of novel chalcone-schiff base hybrid derivatives as HDAC2 inhibitors#990847
- Raw data of blind molecular docking for 2-<i>t</i>-Butyl-5-(dimethoxy-phosphoryl)-3-methyl-4-oxoimidazolidine-1-carboxylic acid, <i>t</i>-butyl ester and 1,2,4-benzenetricarboxylic acid, 1,2-dimethyl ester, showing the docking modes, binding affinities, and RMSD values relative to the best docking poses.#467983
Record · ID 433819
Retrieved via Conceptio: every document is proof-bundled with source, license, and retrieval metadata.
Retrieved via Conceptio: every document is proof-bundled with source, license, and retrieval metadata.
Bring this data into your agent: Connect via MCP or API · 20 free credits to start · no card required
Read the Docs → · View CLI source on GitHub · Conceptio Open Knowledge Archive
Read the Docs → · View CLI source on GitHub · Conceptio Open Knowledge Archive