Head – Computational Chemistry | Hyderabad

Job
November 14, 2026

Job Overview

Job Description

We’re Hiring | Head – Computational Chemistry | Hyderabad Are you ready to shape the future of AI-driven drug discovery? We are seeking an experienced Head – Computational Chemistry to lead strategic initiatives across computational chemistry, cheminformatics, molecular modeling, and machine learning to accelerate our drug discovery programs. In this leadership role, you will drive the adoption of cutting-edge AI/ML technologies, structure-based drug design, predictive modeling, and in-silico discovery workflows while collaborating closely with Medicinal Chemistry, Biology, ADME/Tox, and multidisciplinary research teams. You will also build and mentor a high-performing team of computational scientists and data experts. Requirements: • Ph.D. in Computational Chemistry, Cheminformatics, Bioinformatics, or a related field • 15+ years of experience in Pharmaceutical, Biotechnology, CRO, CRDMO, or CDMO organizations • Strong expertise in Python, PyTorch, TensorFlow, Molecular Modeling, Cheminformatics, and AI/ML applications in Drug Discovery Location: Hyderabad, India If you are passionate about transforming drug discovery through computation, data science, and innovation, we would love to hear from you. Share your profile at mohan.reddy@pihealthsciences.com.