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RSC Chemical Biology|April 1, 2022
Computational analyses of mechanism of action (MoA): data, methods and integrationMaria-Anna Trapotsi, Layla Hosseini-Gerami, Andreas BenderJournal of Chemical Information and Modeling|May 2, 2020
Predicting p<i>K</i><sub>a</sub> Using a Combination of Semi-Empirical Quantum Mechanics and Radial Basis Function MethodsPeter Hunt, Layla Hosseini-Gerami, Tomas Chrien, et al.BMC Bioinformatics|September 15, 2023
MAVEN: compound mechanism of action analysis and visualisation using transcriptomics and compound structure data in R/ShinyLayla Hosseini-Gerami, Rosa Hernansaiz Ballesteros, Anika Liu, et al.Chemical Research in Toxicology|July 9, 2024
Improved Detection of Drug-Induced Liver Injury by Integrating Predicted <i>In Vivo</i> and <i>In Vitro</i> DataSrijit Seal, Dominic Williams, Layla Hosseini-Gerami, et al.Biorxiv : the Preprint Server for Biology|June 19, 2024
Improved Detection of Drug-Induced Liver Injury by Integrating Predicted <i>in vivo</i> and <i>in vitro</i> DataSrijit Seal, Dominic P Williams, Layla Hosseini-Gerami, et al.Journal of Chemical Information and Modeling|February 1, 2024
Insights into Drug Cardiotoxicity from Biological and Chemical Data: The First Public Classifiers for FDA Drug-Induced Cardiotoxicity RankSrijit Seal, Ola Spjuth, Layla Hosseini-Gerami, et al.BMC Bioinformatics|April 18, 2023
Benchmarking causal reasoning algorithms for gene expression-based compound mechanism of action analysisLayla Hosseini-Gerami, Ixavier Alonzo Higgins, David A Collier, et al.Biorxiv : the Preprint Server for Biology|October 31, 2023
Insights into Drug Cardiotoxicity from Biological and Chemical Data: The First Public Classifiers for FDA DICTrankSrijit Seal, Ola Spjuth, Layla Hosseini-Gerami, et al.The Journal of Organic Chemistry|July 21, 2025
Synthesis and Inhibitory Assessment of ACE2 Inhibitors for SARS-CoV-2: An <i>In Silico</i> and <i>In Vitro</i> StudyXiaoyun Wang, Jieyu He, Layla Hosseini-Gerami, et al.Frontiers in Pharmacology|February 23, 2023
<i>In silico</i> prediction and biological assessment of novel angiogenesis modulators from traditional Chinese medicineYingli Zhu, Hongbin Yang, Liwen Han, et al.Pageof 2