Applications of the Novel Quantitative Pharmacophore Activity Relationship Method QPhAR in Virtual Screening and Lead-Optimisation

• Үндсэн зохиолчид: Stefan Michael Kohlbacher (Зохиогч), Matthias Schmid (Зохиогч), Thomas Seidel (Зохиогч), Thierry Langer (Зохиогч)
• Формат: Ном
• Хэвлэсэн: MDPI AG, 2022-09-01T00:00:00Z.
• Нөхцлүүд: article
• Онлайн хандалт: Connect to this object online.

Pharmacophores are an established concept for the modelling of ligand-receptor interactions based on the abstract representations of stereoelectronic molecular features. They became widely popular as filters for the fast virtual screening of large compound libraries. A lot of effort has been put int...