P-glycoprotein (P-gp) is regarded as an important factor in ... and random forest) and their ensemble model using respectively only 3, 9, 7, and 14 descriptors achieve an overall accuracy of ...

Imagine cells navigating through a complex maze, guided by chemical signals and the physical landscape of their environment.

A new concept of kinetic modules in biochemical networks could revolutionize the understanding of how these networks function ...

The liver has a unique structure, especially at the level of individual cells. Hepatocytes, the main liver cells, release ...

(1) We released the 50 diffusion steps model (instead of 1000 steps) which runs 20X faster with comparable results. (2) Calling CLIP just once and caching the result runs 2X faster for all models.

*Laboratory of Pharmaceutical Engineering, University of Franche-Comté, 19, rue Ambroise Paré, 25000 Besançon, France. Tel: +33 3 63 08 23 38. Fax: +33 3 81 66 52 90. E-mail: [email protected].