The role of multidrug resistance protein (MRP-1) as an active efflux transporter on blood–brain barrier (BBB) permeability

Classification of Breast Cancer Resistant Protein (BCRP) Inhibitors and Non-Inhibitors Using Machine Learning Approaches

(2015) Vilas Belekar et al.   COMBINATORIAL CHEMISTRY & HIGH THROUGHPUT SCREENING

Role of breast cancer resistance protein (BCRP) as active efflux transporter on blood-brain barrier (BBB) permeability

(2014) Prabha Garg et al.   MOLECULAR DIVERSITY

A fragment-based approach for the in silico prediction of blood-brain barrier permeation

(2013) Tiago L. Moda et al.   JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY

Refined structures of mouse P-glycoprotein

(2013) Jingzhi Li et al.   PROTEIN SCIENCE

Computational Prediction of CNS Drug Exposure Based on a Novel In Vivo Dataset

(2012) Christel A. S. Bergström et al.   PHARMACEUTICAL RESEARCH

In-silico prediction of blood–brain barrier permeability

(2012) A. Yan et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

Qualitative prediction of blood–brain barrier permeability on a large and refined dataset

(2011) Markus Muehlbacher et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Insights for Predicting Blood-Brain Barrier Penetration of CNS Targeted Molecules Using QSPR Approaches

(2010) Yi Fan et al.   Journal of Chemical Information and Modeling

A prediction model for blood–brain barrier permeation and analysis on its parameter biologically

(2009) Yan Chen et al.   COMPUTER METHODS AND PROGRAMS IN BIOMEDICINE

Brain drug targeting: a computational approach for overcoming blood–brain barrier

(2009) Ahmad Reza Mehdipour et al.   DRUG DISCOVERY TODAY

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

(2009) Oleg Trott et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Automatic QSAR modeling of ADME properties: blood–brain barrier penetration and aqueous solubility

(2008) Olga Obrezanova et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Generation of a Set of Simple, Interpretable ADMET Rules of Thumb

(2008) M. Paul Gleeson   JOURNAL OF MEDICINAL CHEMISTRY

New Predictive Models for Blood–Brain Barrier Permeability of Drug-like Molecules

(2008) Sandhya Kortagere et al.   PHARMACEUTICAL RESEARCH

QSAR Modeling of the Blood–Brain Barrier Permeability for Diverse Organic Compounds

(2008) Liying Zhang et al.   PHARMACEUTICAL RESEARCH

In SilicoPrediction of Blood–Brain Partitioning Using a Chemometric Method Called Genetic Algorithm Based Variable Selection

(2008) Jie Shen et al.   Quantitative structure-activity relationships & combinatorial science

Molecular modeling of the human multidrug resistance protein 1 (MRP1/ABCC1)

(2007) Marianne K. DeGorter et al.   BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS

ABC multidrug transporters: structure, function and role in chemoresistance

(2007) Frances J Sharom   PHARMACOGENOMICS