Services & Courses
We provide expert-led training, project support, and innovative research solutions in CADD and Bioinformatics for students, researchers, and professionals.
🧪 Ligand similarity search, ligand modeling and generation of ligand library
Dive into the fundamentals and advanced techniques of ligand-based drug design. This hands-on training will guide you through modeling ligands from scratch, generating massive compound libraries, and retaining critical functional groups in novel analogs. Perfect for researchers and scientists aiming to strengthen their skills in computational ligand design.
What to expect:
- Perform ligand similarity search on databases.
- Model and build ligand from scratch
- Generate novel ligand database (Up to a million compound)
- Generate novel compounds' structural analog
- How to retain compounds' specific/interested functional group in structural analogs
Our Services
CompChem Hub specializes in CADD, Bioinformatics, and Capacity building services, empowering researchers and students to advance their drug discovery and computational sciences knowledge.
Computer Aided Drug Design (CADD)
Our CADD platform leverages advanced computational methods, including molecular modeling, molecular dynamics simulations, QSAR, DFT calculation, pharmacophore modeling and virtual screening to design and optimize small molecules. Our expert team utilizes a range of software and tools, to predict the efficacy and safety of potential lead compounds.
Bioinformatics
Our Bioinformatics service applies cutting-edge computational tools to analyze and interpret complex biological data, including phylogenetic analysis, bacterial/viral genomics, molecular modeling, and data mining. We specialize in immunoinformatics—predicting antigenic epitopes, analyzing immune responses, and designing vaccines—and gene silencing, where we identify RNA interference (RNAi) targets and design siRNA molecules. By integrating these advanced approaches, we uncover critical interactions between the immune system and disease, accelerating the discovery of novel diagnostics and therapeutics.
Capacity Building
Our capacity building programs are designed to enhance the skills, knowledge, and expertise of researchers, scientists, and professionals in the life sciences. Through workshops, training sessions, and mentorship opportunities, we provide individuals and groups to strengthen research capacity, improve scientific literacy, and enhance collaboration and innovation.
Learn. Apply. Excel.
Our Courses
Our courses are expertly designed for easy understanding, taught by professionals, and include hands-on practice to build confidence, deepen skills, and empower learners in CADD and Bioinformatics research.

Introduction to CADD & Bioinformatics
Free Virtual Training on Computer-Aided Drug Discovery (CADD), Suitable for all groups, whether you are a beginner or expert.

Molecular Docking Masterclass 1.0
This course equips participants with practical skills to design, execute, and interpret docking studies confidently

💊 Pharmacodynamics & Pharmacokinetics Workshop
Understand how drugs interact with the body and predict their behavior using scientific models.

Advance Course
Ligand Similarity Search, Ligand Modeling, and Ligand Library Generation

Advance Course
Molecular docking masterclass 2.0 (Ligand-based drug design)

Advance Course
Bioinformatics and genomic study of infectious disease (to include AMR gene study)
Projects Simplified with Expertise
Project Management
We provide expert guidance and handling of CADD and bioinformatics projects, providing excellent research design, analysis, and publication-ready outcomes.