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From the employer's careers site First seen 27 Oct 2026 · Still live on 31 Oct 2026

Senior Director / Vice President, Machine Learning (Generative Chemistry)

Description

FL117, a venture-backed stealth AI x bio startup, is seeking a highly skilled Sr. Director/VP ML, Generative Chemistry. You will lead AI/ML and cheminformatics projects building the next-gen multi-modal generative models for biomolecular design. You will define and deliver pragmatic AI strategies, oversee method and platform development, and ensure rigor in model development, benchmarking, and scaling.

Responsibilities:

  • Program Leadership: Lead development, implementation, control, and reporting of several AI/ML or computational projects within assigned ventures in line with broader strategic plans of PI and Flagship, budgets, and timelines.
  • Technical Ownership: Take a specialized technical role on project teams to oversee method development, pipeline development, and LLM based agent/workflow design; drive benchmarking, scaling, and implementation into production grade systems.
  • Best Practices: Promote operational excellence in AI projects by educating cross-functional collaborators.
  • Team Leadership: Manage and/or coordinate internal scientists and engineers and cross functional project teams as applicable; mentor early hires; support recruiting and interview.
  • Planning & Resourcing: Contribute to project planning, including budgets, resources, and timelines; surface risks and tradeoffs early with clear options.
  • Landscape & Strategy: Independently scout emerging literature and the AI/ML landscape; synthesize concepts to propose new development strategies and identify opportunities for PI and venture portfolios.

Must-have Qualifications:

  • MSc or PhD in Computer Science, AI/ML, Physics, Biophysics, or a related field
  • 7+ years of experience scientific/engineering/computational in Pharma or Biotech settings; industry AI/ML experience preferred
  • Experience driving results directly or indirectly through teams of engineers/scientists in dynamic, fast paced, entrepreneurial, and technical environments.
  • Clear evidence of sustained independent thought and creativity driving high impact, across drug development and chemistry AI/ML projects.
  • Successful track record of leadership and contribution to decision making on progression of AI/ML models within projects or programs.
  • Depth across multiple core tools and concepts, including Python; modern ML frameworks (PyTorch or JAX/TensorFlow); version control; databases; deep learning architectures; and relevant informatics software.
  • Consistent record of outstanding performance reflected in publications, patents, or high impact internal reports where applicable

Preferred Experience:

  • Breadth across domains such as protein modeling/design, cheminformatics/docking/ADMET, biophysics/MD, and LLM/agentic automation.
  • Strong presence in the ML community through publications and conference proceedings.
  • MLOps expertise: data contracts and lineage (e.g., DVC/LakeFS), experiment tracking (MLflow/W&B), secure AWS infrastructure (S3, Batch/ECS/EKS, SageMaker), Docker, IaC (Terraform/CDK), and CI/CD (GitHub Actions).
  • Generative modeling (diffusion/flow/VAEs) for sequences, graphs, or 3D structures; docking rescoring (e.g., gnina, DiffDock) and pose quality metrics.
  • Workflow orchestration (Airflow/Prefect/Argo), data warehouses (Redshift/Snowflake), vector search (FAISS/pgvector), and lightweight internal tools (FastAPI, Streamlit/Gradio).
  • Familiarity with ML software development and cloud services (Docker, AWS Batch, Step Functions, EKS, AWS ParallelCluster, etc.)
  • Experience with libraries like: rdkit, rosetta, prody, biopython, pymol, openmm, dagster, prefect, etc.
  • Experience mentoring early hires, acting as interim Head of ML, and contributing to hiring plans and interview processes at startups.

The salary range for this role is $279,000 - $412,500. FL117 currently offers healthcare coverage, annual incentive program, retirement benefits and a broad range of other benefits.

Skills

Required

  • Python
  • modern ML frameworks (PyTorch or JAX/TensorFlow)
  • version control
  • databases
  • deep learning architectures
  • informatics software

Nice to have

  • breadth across domains such as protein modeling/design, cheminformatics/docking/ADMET, biophysics/MD, and LLM/agentic automation
  • strong presence in the ML community through publications and conference proceedings
  • MLOps expertise
  • generative modeling
  • workflow orchestration
  • data warehouses
  • vector search
  • lightweight internal tools
  • familiarity with ML software development and cloud services
  • experience with libraries like: rdkit, rosetta, prody, biopython, pymol, openmm, dagster, prefect

Ready to apply?

You apply with the employer directly. Their original posting is here: https://job-boards.greenhouse.io/flagshippioneeringinc/jobs/8843608002

Apply on FL117, a venture-backed stealth AI x bio startup