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Temporary Machine Learning Postdoc information

What are the key skills and qualifications needed to thrive as a Temporary Machine Learning Postdoc, and why are they important?

To thrive as a Temporary Machine Learning Postdoc, you need a PhD in a relevant field, a solid grasp of machine learning theory, and strong programming skills (often in Python or R). Experience with tools such as TensorFlow, PyTorch, and high-performance computing environments, as well as a record of peer-reviewed research, is typically required. Strong analytical thinking, collaboration, and effective communication help you stand out in this research-intensive role. These skills are essential for advancing cutting-edge research, publishing impactful findings, and contributing to interdisciplinary projects.

What types of projects and collaborations can a Temporary Machine Learning Postdoc expect to engage in during their appointment?

A Temporary Machine Learning Postdoc typically works on cutting-edge research projects, often contributing to ongoing studies or initiating novel investigations within the field. Collaboration is common, both within their immediate research group and with interdisciplinary teams, such as data scientists, domain experts, or industry partners. Postdocs may also mentor graduate students, present findings at conferences, and publish papers, gaining valuable experience that can lead to academic or industry roles. The environment is fast-paced and research-driven, offering opportunities for professional growth and expanding one's research portfolio.

What is a Temporary Machine Learning Postdoc?

A Temporary Machine Learning Postdoc is a fixed-term research position, typically held at a university or research institution, focused on advancing knowledge and techniques in machine learning. Postdoctoral researchers in this role work on specific projects, often collaborating with faculty, graduate students, or industry partners. The position is designed to provide advanced training and research experience after earning a PhD, usually lasting from several months to a couple of years. Temporary postdocs may contribute to publishing academic papers, developing algorithms, and mentoring students, while preparing for longer-term academic or industry careers.

What is the difference between Temporary Machine Learning Postdoc vs Data Scientist?

AspectTemporary Machine Learning PostdocData Scientist
CredentialsPhD in Computer Science, Data Science, or related fieldBachelor's or Master's in Data Science, Computer Science, or related field; often requires experience
Work EnvironmentAcademic or research institutions, labsCorporate, tech companies, startups
Employer & Industry UsageUniversities, research centersBusiness, technology, finance, healthcare
Search & Comparison IntentUnderstanding research-focused roles, academic opportunitiesIndustry roles, applied data analysis, business impact

The Temporary Machine Learning Postdoc is primarily research-oriented, often in academic or research settings, requiring a PhD. In contrast, a Data Scientist typically works in industry, applying data analysis and machine learning to solve business problems, often with a Bachelor's or Master's degree. Both roles involve machine learning skills but differ in environment, focus, and experience level.

What are the most commonly searched types of Machine Learning Postdoc jobs in Pittsburgh, PA? The most popular types of Machine Learning Postdoc jobs in Pittsburgh, PA are:
What are popular job titles related to Temporary Machine Learning Postdoc jobs in Pittsburgh, PA? For Temporary Machine Learning Postdoc jobs in Pittsburgh, PA, the most frequently searched job titles are:
What job categories do people searching Temporary Machine Learning Postdoc jobs in Pittsburgh, PA look for? The top searched job categories for Temporary Machine Learning Postdoc jobs in Pittsburgh, PA are:
Temporary Machine Learning Postdoc jobs near you
Postdoctoral Research Associate - Isayev Lab

Postdoctoral Research Associate - Isayev Lab

Carnegie Mellon University

Pittsburgh, PA • On-site

Full-time

Posted 29 days ago

Carnegie Mellon University rating

8.6

Company rating: 8.6 out of 10

Based on 24 frontline employees who took The Breakroom Quiz

67th of 612 rated colleges and universities

Job description

Description
The Isayev Lab at Carnegie Mellon University invites applications for a postdoctoral researcher to lead projects at the interface of computational chemistry, machine learning, reaction mechanism elucidation, and automated molecular discovery. The position is ideal for a candidate who wants to turn deep mechanistic understanding into predictive models and closed-loop discovery workflows.
Our lab develops and applies machine learning methods for computational chemistry, materials science, and molecular discovery, including transferable neural network potentials, generative molecular design, and experiment-automation workflows. The postdoc will work in a collaborative CMU environment spanning computational chemistry, AI, automated experimentation, polymer chemistry, and catalysis.
Research directions may include:
Developing automated DFT / ML workflows for mechanistic studies of photoredox, organometallic, and radical catalytic reactions.
Building predictive models that connect quantum-chemical descriptors, catalyst structure, substrate scope, selectivity, and reaction performance.
Applying AIMNet2 and related ML/QM methods to accelerate conformer search, reaction-path exploration, catalyst screening, and high-throughput mechanistic modeling.
Designing closed-loop computational-experimental campaigns for transition metal catalysis, polymer synthesis, and related catalytic transformations.
Creating reusable, open, well-documented software workflows for reaction data generation, curation, featurization, and model deployment.
Collaborating with experimental groups at CMU and external partners to convert mechanistic hypotheses into experimentally testable predictions.
Qualifications
Desired background:
Ph.D. in chemistry, chemical engineering, materials science, or a related field.
Strong experience in computational reaction mechanisms, especially DFT studies of organic, organometallic, photoredox, radical, or homogeneous catalytic systems.
Fluency with Python and modern scientific computing workflows; experience with Git, HPC clusters, SLURM, Gaussian, ORCA, Q-Chem, xTB, RDKit, ASE, or related tools is highly valued.
Interest in machine learning, statistical modeling, active learning, descriptor development, or data-driven reaction prediction.
Ability to work closely with experimental collaborators and communicate mechanistic insight clearly.
Application Instructions
Applications, including a cover letter and a curriculum vitae indicating your interest and relevant training should be submitted electronically via Interfolio.

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