Director, Computational Chemist

Summary

Join Genesis Therapeutics, a leader in AI-driven drug discovery, as their Director of Computational Chemistry. In this strategic role, you will lead a team, develop and implement cutting-edge computational chemistry strategies, collaborate with cross-functional teams, and mentor team members. You will utilize physics-based and AI-driven approaches to accelerate drug discovery, focusing on small molecule therapies. The ideal candidate possesses a Ph.D. in a relevant field, extensive experience in computational chemistry, and a proven track record of leadership. This position offers the opportunity to shape the future of drug discovery at a rapidly growing company.

Requirements

• Ph.D. in Computational or Theoretical Chemistry, Physics, or Biophysics, or a related field with a robust emphasis on computational method development
• 8+ years of experience in computational chemistry within biotech, pharma, or related industries
• Proven track record in leadership, with the ability to mentor scientists and drive cross-functional collaboration
• Deep expertise in molecular dynamics simulations, enhanced sampling techniques, free energy calculations, and quantum chemistry methods
• Strong background in method development, including algorithm design and implementation tailored for drug discovery
• Proficiency with computational chemistry software (e.g., AMBER, GROMACS, OpenMM, Schrödinger, etc.)
• Strong programming skills in Python
• Experience applying machine learning to molecular modeling challenges, such as generative models, deep learning for structure-based design, or AI-driven virtual screening
• Exceptional problem-solving, analytical, and communication skills
• Ability to thrive in a fast-paced, multidisciplinary environment
• A passion for innovation and a commitment to advancing precision therapies through computational science

Responsibilities

• Define and execute a comprehensive computational chemistry strategy that leverages both physics-based and AI-driven approaches to accelerate drug discovery
• Collaborate with cross-functional teams—including medicinal chemists, biologists, and ML researchers—to integrate computational insights into the broader therapeutic development process
• Play a pivotal role in shaping the future of small molecule therapies at Genesis Therapeutics
• Design and execute state-of-the-art molecular dynamics simulations, enhanced sampling techniques, quantum chemistry calculations, and free energy calculations to improve ligand binding predictions and optimize molecular properties such as ADMET
• Develop novel computational methodologies integrating physics and AI/ML to address complex challenges in drug discovery
• Stay abreast of emerging computational techniques and incorporate innovative methods into our research workflows to maintain a competitive edge
• Work closely with internal stakeholders to generate actionable insights that drive lead optimization and structure-based drug design
• Effectively communicate scientific findings, strategic approaches, and progress updates to both technical and non-technical audiences, including leadership teams and external partners
• Lead and grow a high-performing team of computational scientists by fostering a collaborative, innovative, and results-oriented work environment
• Mentor team members and encourage professional development, ensuring continuous improvement and thought leadership within the field