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Predictive toxicology

Integrative network toxicology and molecular docking reveal 4-Nonylphenol’s multifaceted mechanisms in breast cancer pathogenesis

Congli Jia, Fu Yang

Targeted drug screening for autism based on Cav1.2 calcium ion channel

Chao Liu

Innovation of eco-friendly TiO2 nano catalyst for new pyrimidine carbonitiriles candidates, assessed for significant antioxidant activity, anti-inflammatory effects, and by insilico studies

Wesam S. Shehab, Ahmed F. EL-Farargy, [ ... ], Magda H. Abdellattif

Advancing patient care: Machine learning models for predicting grade 3+ toxicities in gynecologic cancer patients treated with HDR brachytherapy

Andres Portocarrero-Bonifaz, Salman Syed, [ ... ], Scott R. Silva

Design, synthesis, and in vitro evaluation of a carbamazepine derivative with antitumor potential in a model of Acute Lymphoblastic Leukemia

Cristian Álvarez-Gómez, Angela V. Fonseca-Benítez, James Guevara-Pulido

Drug-induced cytotoxicity prediction in muscle cells, an application of the Cell Painting assay

Roman Lambert, Eva Serrano Candelas, [ ... ], Howard Oliver Fearnhead

Immunoinformatic evaluation for the development of a potent multi-epitope vaccine against bacterial vaginosis caused by Gardnerella vaginalis

Hamid Motamedi, Saeed Shoja, Maryam Abbasi

Combined immunoinformatic approaches with computational biochemistry for development of subunit-based vaccine against Lawsonia intracellularis

Zahed Khatooni, Gordon Broderick, Sanjeev K. Anand, Heather L. Wilson

Designing of a multiepitope-based vaccine against echinococcosis utilizing the potent Ag5 antigen: Immunoinformatics and simulation approaches

Rehana Parvin, Md. Habib Ullah Masum, [ ... ], A. M. A. M. Zonaed Siddiki

Exploring effector protein dynamics and natural fungicidal potential in rice blast pathogen Magnaporthe oryzae

Jannatul Ferdousy, Tanjin Barketullah Robin, [ ... ], Mohammad Shahadat Hossain

DigiLoCS: A leap forward in predictive organ-on-chip simulations

Manoja Rajalakshmi Aravindakshan, Chittaranjan Mandal, [ ... ], Christian Maass

Comprehensive in silico analyses of fifty-one uncharacterized proteins from Vibrio cholerae

Sritapa Basu Mallick, Sagarika Das, [ ... ], Partha Pratim Datta

Genomic selection for tolerance to aluminum toxicity in a synthetic population of upland rice

Jérôme Bartholomé, José Omar Ospina, [ ... ], Cécile Grenier

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