Computational Materials Science, Formulations
Core
Computational Materials Scientist performing molecular simulations and formulation research using Schrödinger tools to solve industrial R&D problems.
Role type
Senior IC computational materials scientist
Builds
Production simulation workflows and data analysis pipelines for industrial partners
Domain
Computational chemistry and materials science
Deliverable
production ML models
Required skills
Molecular dynamics (MD) simulations, coarse-grained simulation (DPD/Martini), enhanced sampling techniques, Python scripting, shell scripting, high-performance computing (HPC), Linux
Preferred skills
All-atom simulations, complex formulation modeling, scientific software integration
Technologies
Schrödinger, Python, Shell, Linux, HPC
Responsibilities
Perform molecular simulations using Schrödinger tools, develop automation scripts for high-throughput simulations, collaborate on cross-functional molecular modeling solutions, present technical results to stakeholders, contribute to scientific publications
Seniority
Senior, hands-on IC