Beschreibung

You will develop advanced scientific software, focusing on high-performance computing, integrating machine learning, and improving crystal structure prediction, while collaborating with a skilled team.

Anforderungen

• •Commitment to reduce carbon footprint
• •Team player
• •Can-do attitude
• •Readiness to accept guidance
• •Rigorous, precise, and solution-oriented
• •Ability to execute complex sub-projects
• •Pragmatic with historical code constraints
• •Genuine interest in efficient algorithms
• •Intercultural awareness
• •Expert knowledge in relevant domains
• •Object-oriented programming in C++
• •Strong molecular modelling background
• •Fluent scientific English
• •Master's in computer science or PhD

Aufgaben

• •Start in a permanent position within three months.
• •Join a team of Scientific Software developers.
• •Report to the Science and IT Director and HR Director.
• •Expand GRACE based on your interests and skills.
• •Navigate company networks and clouds for cost-effective computing.
• •Enhance crystal structure prediction using crystallographic databases.
• •Simulate experimental data from complex crystalline structures.
• •Implement force field technology for various hardware environments.
• •Scale ab-initio grade force fields to supercomputer size.
• •Implement high-value data flow processes in molecular dynamics.
• •Introduce machine learning techniques in molecular modeling workflows.
• •Contribute to predicting the solubility of pharmaceutical compounds.
• •Tackle dynamic aspects of crystallization using computational infrastructure.
• •Create math libraries for scientific software in C++.
• •Train new software developers in C++ programming.

Tools & Technologien

Benefits