
Specialist - Computational Chemistry & AI ML
1 day ago
This role offers the opportunity to apply cutting-edge AI/ML methodologies to accelerate the identification, design, and optimization of novel therapeutics, working at the interface of computational science, medicinal chemistry, and biology.
Key Responsibilities
- AI-Driven Drug Discovery: Develop, validate, and deploy state-of-the-art ML models (incl. de novo design, virtual screening, ADMET modeling, and hit-to-lead optimization).
- Scientific Integration: Collaborate with medicinal chemists, biologists, and computational scientists to incorporate AI-derived insights into discovery workflows.
- Platform Development: Architect and maintain AI/ML infrastructure to enable efficient data analysis and hypothesis generation.
- Research & Innovation: Monitor advancements in AI/ML for drug discovery, contribute to proprietary methods, and support intellectual property generation.
- Data Translation: Analyze complex datasets and present actionable recommendations to multidisciplinary teams.
Required Qualifications
- Education: Ph.D. in Computational/Medicinal Chemistry, Bio/Cheminformatics, AI/ML, or related discipline, with 3–6 years post-doctoral or industry experience.
- Technical Skills:
- Expertise in deep learning architectures (CNNs, RNNs, Transformers)
- Proficiency in Python and ML frameworks (TensorFlow, PyTorch)
- Experience with both structure-based and ligand-based drug discovery approaches
- Mindset: Strong interest in agentic AI — autonomous, goal-driven systems for scientific discovery.
- Soft Skills: Excellent communication, problem-solving, and cross-functional collaboration abilities.
Why Join Us?
At Aurigene, you will work on high-impact scientific programs, leveraging advanced computational tools to shorten the drug discovery timeline and improve success rates. You will be part of a collaborative, innovation-driven environment where science meets technology to create real-world health impact.
-
Specialist - Computational Chemistry & AI ML
5 days ago
Bengaluru, Karnataka, India Aurigene Pharmaceutical Services Limited Full timeThis role offers the opportunity to apply cutting-edge AI/ML methodologies to accelerate the identification, design, and optimization of novel therapeutics, working at the interface of computational science, medicinal chemistry, and biology. Key Responsibilities AI-Driven Drug Discovery: Develop, validate, and deploy state-of-the-art ML models (incl. de novo...
-
Specialist - Computational Chemistry & AI ML
7 days ago
Bengaluru, Karnataka, India Aurigene Pharmaceutical Services Limited Full timeThis role offers the opportunity to apply cutting-edge AI/ML methodologies to accelerate the identification, design, and optimization of novel therapeutics, working at the interface of computational science, medicinal chemistry, and biology.Key ResponsibilitiesAI-Driven Drug Discovery: Develop, validate, and deploy state-of-the-art ML models (incl. de novo...
-
Bengaluru, Karnataka, India Aurigene Pharmaceutical Services Limited Full timeThis role offers the opportunity to apply cutting-edge AI/ML methodologies to accelerate the identification, design, and optimization of novel therapeutics, working at the interface of computational science, medicinal chemistry, and biology.Key Responsibilities- AI-Driven Drug Discovery: Develop, validate, and deploy state-of-the-art ML models (incl. de novo...
-
AI-Driven Medicinal Chemistry Specialist
3 days ago
Bengaluru, Karnataka, India beBeeArtificialintelligence Full time ₹ 1,50,00,000 - ₹ 2,50,00,000Job Title: AI-Driven Medicinal Chemistry Specialist"> In this role, you will have the opportunity to apply cutting-edge AI and machine learning methodologies to accelerate the identification, design, and optimization of novel therapeutics. You will work at the interface of computational science, medicinal chemistry, and biology.">Key...
-
Computer-Aided Therapeutic Design Specialist
6 days ago
Bengaluru, Karnataka, India beBeeDrugDiscovery Full time ₹ 2,00,00,000 - ₹ 2,50,00,000Computational Chemistry SpecialistWe are seeking a skilled Computational Chemistry Specialist to join our team.This role offers the opportunity to apply cutting-edge AI/ML methodologies to accelerate the identification, design, and optimization of novel therapeutics.Key Responsibilities:Develop, validate, and deploy state-of-the-art ML models (incl. de novo...
-
AI /Ml Engineer
12 hours ago
Bengaluru, Karnataka, India Weekday AI Full timeThis role is for one of Weekday's clientsSalary range: Rs 1200000 - Rs 2000000 (ie INR 12-20 LPA)Min Experience: 6 yearsLocation: BengaluruJobType: full-timeRequirementsAbout the role- Design, develop, and implement AI/ML models and algorithms.- Build Proof of Concept (POC) applications to demonstrate feasibility and business value.- Write clean, efficient,...
-
AI /Ml Engineer
21 hours ago
Bengaluru, Karnataka, India Weekday AI Full time ₹ 12,00,000 - ₹ 20,00,000This role is for one of Weekday's clientsSalary range: Rs Rs ie INR 12-20 LPA)Min Experience: 6 yearsLocation: BengaluruJobType: full-timeAbout the roleDesign, develop, and implement AI/ML models and algorithms. Build Proof of Concept (POC) applications to demonstrate feasibility and business value. Write clean, efficient, and well-documented code....
-
AI /Ml Engineer
22 hours ago
Bengaluru, Karnataka, India Weekday AI Full time ₹ 12,00,000 - ₹ 20,00,000 per yearThis role is for one of Weekday's clientsSalary range: Rs Rs ie INR 12-20 LPA)Min Experience: 6 yearsLocation: BengaluruJobType: full-timeRequirementsAbout the roleDesign, develop, and implement AI/ML models and algorithms.Build Proof of Concept (POC) applications to demonstrate feasibility and business value.Write clean, efficient, and well-documented...
-
AI Research Specialist
6 days ago
Bengaluru, Karnataka, India beBeeComputationalBiology Full time ₹ 2,00,00,000 - ₹ 2,50,00,000We're seeking a seasoned academic specialist to lead cutting-edge research in AI, ML, and computational biology.The ideal candidate will have a strong academic background in AI, ML, and NGS with hands-on experience in computational biology and advanced biological data analysis.Key ResponsibilitiesDevelop and deliver training modules in AI, ML, and...
-
AI/ML Engineer
3 days ago
Bengaluru, Karnataka, India beBeeCloudServices Full time ₹ 20,00,000 - ₹ 25,00,000Job Title\AI/ML Engineer - Cloud Services SpecialistAbout the Job\We are seeking an experienced AI/ML Engineer to join our team as a Cloud Services Specialist.Responsibilities\Lead the development and deployment of cloud-based AI and ML solutions.Design, build, and maintain scalable and secure cloud architectures.Collaborate with cross-functional teams to...