Medicinal Chemistry search menu search content In silico drug design What is in silico drug design? In silico drug design is a term that means ‘computer-aided molecular design’, or in other words the rational design or discovery of drugs using a wide variety of computational methods. Especially …

Emine Derin doctoral scholarship holder Research Emine Derin Research team Laboratory for Microbiology, Parasitology and Hygiene (LMPH) Functional characterization of In silico optimized antimicrobial peptides from the black soldier fly for therapeutic applications. 15/07/2025 - 14/07/2026 Abstract …

Laboratory of Experimental Hematology search menu search content LEH - ImmuneWatch - Quantoom Biosciences Public-private partnership ImmuneWatch, Quantoom Biosciences (Univercells) and LEH (UAntwerp) join forces to explore new in vitro and in silico assays that predict T cell responses in vaccines B…

Mathias Huybrechts predoc researcher FWO Research Mathias Huybrechts Research team Experimental Neurobiology Unit (ENU) Language in vivo and in silico: understanding the neural dynamics of language comprehension in the ageing brain through computational linguistics. 01/11/2025 - 31/10/2029 Abstract …

Nicky de Vrij unpaid staff Research Nicky de Vrij Research team ADReM Data Lab (ADReM) A framework to deduce the convoluted repertoire and epitope hierarchy of human T cell responses in visceral leishmaniasis: patient meets in silico. 01/11/2020 - 31/10/2025 Abstract Visceral leishmaniasis (VL) is o…

Toxicology search menu search content In vitro metabolism & metabolomics Studying human metabolism using in silico and in vitro techniques What? Prediction and elucidation of Phase I & II metabolites & metabolic pathways Characterization of alterations in cellular metabolites How? Elucidation of met…

INSPIRE safety pharmacology search menu search content Work Packages WP1 Enabling technology for safety pharmacology Objectives: Work Package (WP) 1 aims to explore and develop novel technologies that enable more accurate detection of drug-induced CV liabilities. Specifically, WP1 will focus on the …

Jana Baroen researcher Research Jana Baroen Research team Plasma Lab for Applications in Sustainability and Medicine - Antwerp (PLASMANT) Inducing neoantigens with cold atmospheric plasma to improve cancer immunotherapy. 01/11/2024 - 31/10/2027 Abstract Globally, cancer incidence is increasing, with…

NeXED search menu search content DC6 - Gabrielle Guillaume-Boulaire Endocrine and neurodevelopmental disrupting potential of relevant human exposure mixtures The goal of this project is to advance the knowledge on the endocrine disrupting (ED) mechanisms of human exposure mixtures and their potentia…

Medicinal Chemistry search menu search content Research topics Inflammation Cell death/survival In silico drug design Exploratory protease targets Infectious diseases Technology development Cookie prreferences Strictly necessary cookies They are necessary for the proper functioning of the website an…

ECOSPHERE search menu search content Bioavailability and accumulation of micro-and macro-contaminants We study the relative importance of different exposure routes and the effects of environmental conditions on the bioavailability, accumulation, and toxicity of trace metals and other priority and ne…

INSPIRE safety pharmacology search menu search content Webinar Series 2022 INRIA 14 JUNE | 12:00 PM CET (06:00 AM ET): Why talking to a mathematician? What do we mean by 'data analysis'; mathematical modelling; and examples of application. Lecturers: Damiano Lombardy, Research Scientist | Miguel A. …

Computational Materials Modeling for Nanoscience and Innovative Technologies search menu search content Research Our research focuses on nano and mesoscopic physics, with a key goal to characterize materials on all scales between the atomistic and the macroscopic one, and enable their novel function…

NeXED search menu search content DC4 - Muhammad Arslan Aslam Next generation regulatory assessment and identification of endocrine disrupting chemicals The aim of this doctoral project is to explore a mechanism-based approach for identifying and assessing chemicals that may act as endocrine disrupto…

INSPIRE safety pharmacology search menu search content ESR8 Sara Costa Faya An in silico approach to monitor and predict haemodynamics during safety pharmacology studies Host organisation: INRIA, France Supervisors: Dr. Miguel Fernández, Dr. Damiano Lombardi, and Dr. Céline Grandmont LEARN MORE AB…

Computational Materials Modeling for Nanoscience and Innovative Technologies search menu search content Research mission The focus of the group is on a fundamental understanding of the electronic, vibrational, optical, magnetic, and superconducting properties of 2D and bulk materials, as well as on …

Integrated Sustainable Chemistry - InSusChem search menu search content Intelligence in Processes, Advanced Catalysts and Solvents - iPRACS Intelligence in Processes, Advanced Catalysts and Solvents - iPRACS iPRACS aspires to change the way innovations in circular and sustainable processes are done,…

Sustainable water management search menu search content Research Topics Research topics We are supported by a broad array of top notch technology platforms available in the involved research groups. The technology allows high level organic and elemental analysis complemented by an array of (eco)toxi…

Computational Materials Modeling for Nanoscience and Innovative Technologies search menu search content Possible topics for a Master thesis (list far from exhaustive) Advancing interatomic potentials for molecular dynamics simulations of 2D materials DFT-minus-half method for qubits in broadband sem…

INSPIRE safety pharmacology search menu search content Numerical simulation 02/06/2021 - Sara (ESR #8) In the poster, you see pressure signals obtained from in silico modelling in different conditions, i.e. in a compliant (healthy) and stiff (aged) blood vessel. The picture shows P0 (blue), which is…

Maryam Ghasemitarei unpaid staff Publications Maryam Ghasemitarei Effects of nitro-oxidative stress on biomolecules : part 2 - reactive molecular dynamics simulations Source Biomolecules - ISSN 2218-273X-15:7 (2025) p. 1-27 Author(s) Zhaonan Chai, Yawei Feng, Tong Zhao, Xiaolong Wang, Maksudbek Yusu…

Yoshi Marien tenure track asst. professor Research Yoshi Marien Research team Intelligence in PRocesses, Advanced Catalysts and Solvents (iPRACS) Expertise My research focuses on polymer production and recycling. Key focus areas are (i) polymerization in homogeneous and aqueous dispersed phase syste…

Rai Maciel de Menezes unpaid staff Research Rai Maciel de Menezes Research team Computational materials modeling for nanoscience and innovative technologies (COMMIT) Expertise Magnetism, simulation of spin dynamics and micromagnetics, magnetic skyrmions and spin waves Neuromorphic magnonics in two-d…

Matisse Van Hee predoc researcher FWO Research Matisse Van Hee Research team Laboratory of Applied Microbiology and Biotechnology (LAMB) Exploring the molecular mechanisms and diversity of non ribosomal peptide synthetases (NRPS) in Lactobacillaceae. 01/11/2024 - 31/10/2026 Abstract Lactobacillaceae…

INSPIRE safety pharmacology search menu search content Research Project Architecture While SP has invested heavily in research for evaluation of drug-induced proarrhythmia risk, new forms of CV toxicity have emerged. For instance, SP is challenged to detect and interpret more subtle forms of functio…