Senior AI Scientist: Drug Discovery & Comp Bio (Hybrid)

BlackCube Labs; Boston (MA); Hybrid; USD 90,000 - 103,000; Full time

Job summary

BlackCube Labs is actively seeking a Senior AI Scientist focused on Drug Discovery & Computational Biology. The role blends hybrid Boston-based work with advanced AI/ML to accelerate therapeutic discovery and development.

The ideal candidate has strong experience in drug discovery, computational biology, and cross-disciplinary collaboration to advance research programs. The position targets hybrid work in Boston, MA, with a contractual六+ month tenure and extension potential.

Qualifications

• Deep expertise in applying AI/ML to drug discovery and development.
• Experience in Drug Discovery & Computational Biology.
• AI/ML methods for predictive modeling, lead optimization, translatability.
• Graph ML techniques for biological networks and knowledge graph discovery.
• Virtual screening and AI-driven target discovery, especially for rare diseases.
• AI-driven molecular design for small molecules and biologics with developability assessment.
• Structural biology and integration of structural data into workflows.
• Healthcare domain experience is essential.

Responsibilities

• Apply AI/ML to accelerate drug discovery and development.
• Collaborate with multidisciplinary R&D teams to translate computational insights.
• Leverage graph ML and molecular design for target identification and lead optimization.
• Utilize virtual screening and AI-driven platforms for rare disease research.

Skills

AI in drug discovery

ML for drug discovery

Graph ML

Target identification

Molecular design AI

Structural biology

Healthcare domain

Collaborative research

Tools

Knowledge graphs

Molecular modeling tools

Job description

BlackCube Labs is actively seeking a Senior AI Scientist focused on Drug Discovery & Computational Biology. The role blends hybrid Boston-based work with advanced AI/ML to accelerate therapeutic discovery and development.

The ideal candidate has strong experience in drug discovery, computational biology, and cross-disciplinary collaboration to advance research programs. The position targets hybrid work in Boston, MA, with a contractual六+ month tenure and extension potential.