Computational Chemist
Tasks
- Collaborate with multidisciplinary experimental and modeling teams
- Collaborate with vendor software providers
- Create molecule and chemistry featurization
- Define parameters inputs and guidance for process feature and reactor models
- Design chemistry and materials for screening and optimization
- Evaluate materials and chemistry discovery tools
- Fine tune machine learning interatomic potentials
- Hypothesize and test mechanisms to find root cause
- Present technical material clearly
- Recommend atomic scale changes to structure and processing conditions
- Scope and assess required model level
- Validate and correlate results with real world data
- Validate property prediction using machine learning interatomic potentials
Perks/Benefits
- N/A
Skills/Tech-stack
Ab Initio | C# | ChemProp | Density Functional Theory | Feature Engineering | Fortran | Graph Neural Networks | Interatomic potentials | Language Models | Large Language Models | Linux | Machine Learning | Machine Learning Interatomic Potentials | Molecular Dynamics | Molecular Modeling | MongoDB | Monte Carlo | Neural Networks | Polymer modeling | PyTorch | Python | RDKit | SMILES | SQL | Scikit-learn
Education
N/A
Related jobs
-
SSE_Analytics Enablement INR 2250K-5000KAI/ML | Alteryx | Analytics engineering | Architecture Review | AutomationSenior-level Full Time110380-IND-BENGALURU-INTL BLR Twr-1&2 CARNATION, India2h ago
-
SSE_Analytics Enablement INR 2250K-5000KAlteryx | Architecture Review | Artificial Intelligence | CI/CD | Code AutomationSenior-level Full Time110380-IND-BENGALURU-INTL BLR Twr-1&2 CARNATION, India2h ago
-
Forward Deployed Engineer INR 4500K-7000KAI | APIs | Agentic AI | Developer tools | Enterprise SoftwareHigh-ownership environment | Onsite customer engagement | R and D Collaboration | Structured Product FeedbackSenior-level Full TimeGurugram, Haryana, IN8h ago
-
Entry-level Full TimeBengaluru, India8h ago
-
GCP Data Engineer / Consultant Specialist INR 1500K-2000KAirflow | Alerting | Apache Beam | Automation | BigQueryFlexible working | Inclusive workplace | Opportunities for growth | Professional developmentMid-level Full TimePune, Maharashtra, India R8h ago
-
Senior AI Testing Engineer (Generative AI) INR 2000K-3300KAI Agents | API Testing | AWS | Azure | CI/CDSenior-level Full TimeBangalore North, India9h ago
-
Senior-level Full TimeIN-KA-Bangalore10h ago
-
Senior-level Full TimeIN-KA-Bangalore10h ago
-
Senior-level Full TimeIN-KA-Bangalore10h ago
-
Senior-level Full TimeIN-KA-Bangalore10h ago
-
Senior-level Full TimeIN-KA-Bangalore10h ago
-
Senior-level Full TimeIN-TN-Chennai10h ago
-
Data Science and Tech Lead AMEA INR 2000K-3500KAWS | Agile | Amazon Bedrock | Amazon SageMaker | CI PipelinesSenior-level Full TimePune, ASIA, India10h ago
-
Mid-level Full TimeBangalore, Karnataka, India11h ago
-
Mid-level Full TimeBangalore, Karnataka, India11h ago
-
Mid-level Full TimeBangalore, Karnataka, India11h ago
-
Mid-level Full TimeBangalore, Karnataka, India11h ago
-
Assistant Manager- AI Engineer INR 1500K-2800KAmazon Web Services | Anthropic Claude | Autogen | Azure | Cloud platformMid-level Full TimeBangalore, Karnataka, India11h ago
-
Consultant - Python Developer with Gen AI INR 1500K-2200KAI Search | Agile | Azure | Azure OpenAI | CSSMid-level Full TimeBangalore, Karnataka, India11h ago
-
Senior Software Engineer, AI/ML, AI Garage INR 2500K-4800KApache Beam | BigQuery | Cause analysis | Data Processing | DataflowSenior-level Full TimeHyderabad, Telangana, India11h ago
-
Data Engineer, Play Data Science and Analytics INR 1500K-2500KAI | Automation | C plus plus | Data Infrastructure | Data ModelingMid-level Full TimeBengaluru, Karnataka, India11h ago
-
Data Engineer, YouTube INR 800K-1400KApache Flume | Apache Spark | Cloud Dataflow | Data Analysis | Data ArchitectureMid-level Full TimeBengaluru, Karnataka, India11h ago
-
Practice Customer Engineer, GenAI, Public Sector, Google Cloud INR 2000K-3300KAPIs | Agentic AI | Audit Logging | Cloud Networking | Cloud infrastructureSenior-level Full TimeGurgaon, Haryana, India; Bengaluru, Karnataka, India11h ago
-
Practice Customer Engineer, GenAI, Manufacturing, Google Cloud INR 2000K-3300KAI Agents | Audit Logging | Cloud Architecture | Cloud Computing | Distributed tracingConference participation | Professional development | Technical stakeholder exposure | Travel opportunitiesSenior-level Full TimeMumbai, Maharashtra, India11h ago
-
Forward Deployed Engineer, Generative AI, Google Cloud INR 1800K-3000KAPI Integration | Agent systems | Cloud platform | CrewAI | Data PipelinesMid-level Full TimeMumbai, Maharashtra, India; Bengaluru, Karnataka, India11h ago