Denis Fourches
TitleCited byYear
QSAR modeling: where have you been? Where are you going to?
A Cherkasov, EN Muratov, D Fourches, A Varnek, II Baskin, M Cronin, ...
Journal of medicinal chemistry 57 (12), 4977-5010, 2014
7532014
Trust, but verify: on the importance of chemical structure curation in cheminformatics and QSAR modeling research
D Fourches, E Muratov, A Tropsha
Journal of chemical information and modeling 50 (7), 1189-1204, 2010
4422010
Chemical basis of interactions between engineered nanoparticles and biological systems
Q Mu, G Jiang, L Chen, H Zhou, D Fourches, A Tropsha, B Yan
Chemical reviews 114 (15), 7740-7781, 2014
3262014
Critical assessment of QSAR models of environmental toxicity against Tetrahymena pyriformis: focusing on applicability domain and overfitting by variable selection
IV Tetko, I Sushko, AK Pandey, H Zhu, A Tropsha, E Papa, T Oberg, ...
Journal of chemical information and modeling 48 (9), 1733-1746, 2008
2932008
Quantitative nanostructure− activity relationship modeling
D Fourches, D Pu, C Tassa, R Weissleder, SY Shaw, RJ Mumper, ...
ACS nano 4 (10), 5703-5712, 2010
2632010
Combinatorial QSAR modeling of chemical toxicants tested against Tetrahymena pyriformis
H Zhu, A Tropsha, D Fourches, A Varnek, E Papa, P Gramatica, T Oberg, ...
Journal of chemical information and modeling 48 (4), 766-784, 2008
2442008
ISIDA-Platform for virtual screening based on fragment and pharmacophoric descriptors
A Varnek, D Fourches, D Horvath, O Klimchuk, C Gaudin, P Vayer, ...
Current Computer-Aided Drug Design 4 (3), 191, 2008
1862008
Substructural fragments: an universal language to encode reactions, molecular and supramolecular structures
A Varnek, D Fourches, F Hoonakker, VP Solov’ev
Journal of computer-aided molecular design 19 (9-10), 693-703, 2005
1852005
Applicability domains for classification problems: benchmarking of distance to models for Ames mutagenicity set
I Sushko, S Novotarskyi, R Körner, AK Pandey, A Cherkasov, J Li, ...
Journal of chemical information and modeling 50 (12), 2094-2111, 2010
1652010
Comprehensive characterization of the published kinase inhibitor set
JM Elkins, V Fedele, M Szklarz, KRA Azeez, E Salah, J Mikolajczyk, ...
Nature biotechnology 34 (1), 95, 2016
1592016
Materials cartography: representing and mining materials space using structural and electronic fingerprints
O Isayev, D Fourches, EN Muratov, C Oses, K Rasch, A Tropsha, ...
Chemistry of Materials 27 (3), 735-743, 2015
1512015
Predicting drug-induced hepatotoxicity using QSAR and toxicogenomics approaches
Y Low, T Uehara, Y Minowa, H Yamada, Y Ohno, T Urushidani, A Sedykh, ...
Chemical research in toxicology 24 (8), 1251-1262, 2011
1512011
CERAPP: collaborative estrogen receptor activity prediction project
K Mansouri, A Abdelaziz, A Rybacka, A Roncaglioni, A Tropsha, A Varnek, ...
Environmental health perspectives 124 (7), 1023-1033, 2016
1372016
Clozapine-induced agranulocytosis is associated with rare HLA-DQB1 and HLA-B alleles
JI Goldstein, LF Jarskog, C Hilliard, A Alfirevic, L Duncan, D Fourches, ...
Nature communications 5, 4757, 2014
1202014
Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species
D Fourches, JC Barnes, NC Day, P Bradley, JZ Reed, A Tropsha
Chemical research in toxicology 23 (1), 171-183, 2009
1192009
Trust, but verify II: a practical guide to chemogenomics data curation
D Fourches, E Muratov, A Tropsha
Journal of chemical information and modeling 56 (7), 1243-1252, 2016
1002016
Curation of chemogenomics data
D Fourches, E Muratov, A Tropsha
Nature chemical biology 11 (8), 535, 2015
942015
Modeling Liver-Related Adverse Effects of Drugs Using kNearest Neighbor Quantitative Structure−Activity Relationship Method
AD Rodgers, H Zhu, D Fourches, I Rusyn, A Tropsha
Chemical research in toxicology 23 (4), 724-732, 2010
872010
Exploring quantitative nanostructure-activity relationships (QNAR) modeling as a tool for predicting biological effects of manufactured nanoparticles
D Fourches, D Pu, A Tropsha
Combinatorial Chemistry & High Throughput Screening 14 (3), 217-225, 2011
822011
Tuning HERG out: antitarget QSAR models for drug development
R C Braga, V M Alves, M FB Silva, E Muratov, D Fourches, A Tropsha, ...
Current topics in medicinal chemistry 14 (11), 1399-1415, 2014
772014
The system can't perform the operation now. Try again later.
Articles 1–20