India Computational chemistry Jobs – 45 Open Jobs Today

Computational Materials and Chemistry Scientist
Applied Materials —Bengaluru, Karnataka
- Full-time
- SQL
- Machine learning
- Travel
- Work from home
Chemistry Research Mentor (Remote)
7dna Analytica Private Limited —Remote
- ₹500 - ₹2,000 an hour
- Remote
- Doctoral degree
- Research
- Mentoring
Quick apply
Scientist (Computational Chemistry / Materials & Molecular Modeling)
Aganitha AI —Hyderabad, Telangana
- Full-time
- Doctoral degree
- Research
- C++
Scientific Manager -Computational Toxicology
Auxilife Scientific Services Pvt. Ltd. —Pune, Maharashtra
- Full-time
- Doctoral degree
- Master's degree
- Project management
Quick apply
Computational Chemometrics Researcher
Shell Energy —Bengaluru, Karnataka
- Full-time
- Doctoral degree
- Research
- Machine learning
10d
Computational Chemometrics Researcher
Shell —Bengaluru, Karnataka
- Full-time
- Doctoral degree
- Research
- Machine learning
10d
Project Technical Support - III
Santosh Deemed to be University —Delhi, Delhi
- ₹28,000 a month
- Master's degree
- Project management
- Bachelor's degree
2d
Scientist (Bioinformatics & Computational Biology)
Aganitha AI —Hyderabad, Telangana
- Doctoral degree
- AI
CA0302 - Postdoctoral Research - Computational Biology
Cloudangles —Hyderabad, Telangana
- Doctoral degree
- Research
- Scripting
Quick apply
12d
Job Description - Internship - Insilico
Quantumzyme —Bengaluru, Karnataka
- Master's degree
- Scripting
- Internship
Scientist (Computational Chemistry / Structural Biology & Biomolecular Modeling)
Aganitha AI —Hyderabad, Telangana
- Full-time
- Doctoral degree
- C++
- Scripting
Computational Physicist Semiconductor Process Modeling
Applied Materials —Bengaluru, Karnataka
- Full-time
- Doctoral degree
- Data analysis skills
- C++
- Work from home
Data Scientist
Fluence Energy —Bengaluru, Karnataka
- Full-time
- English
- Master's degree
- SQL
Quality Assurance (QA) Engineer
Aganitha AI —Chennai, Tamil Nadu
- Full-time
- Master's degree
- AI
Freelance – Cheminformatics & Cardiotoxicity Assessment Expert
Guires Solutions Private Limited —Remote
- From ₹10,000 a month
- Part-time
- Remote
- Doctoral degree
- Research
- Master's degree
Quick apply
14d
Deputy Editor, Physical Sciences
Wiley —Noida, Uttar Pradesh
- Full-time
- Doctoral degree
- English
- Research
Executive - Analytical R&D | Inhalation
Amneal Pharmaceuticals —Ahmedabad, Gujarat
- Full-time
- Research
- Master's degree
- Bachelor's degree
Jr Product/Solutions Manager
Aganitha AI —Hyderabad, Telangana
- Full-time
- Master's degree
- Business Administration
- AI
Scientist (AI Modeling for Computational Sciences)
Aganitha AI —Hyderabad, Telangana
- Full-time
- Doctoral degree
- Research
- Machine learning
Research Associate I, R&D Complex Product Development
Baxter —Ahmedabad, Gujarat
- Doctoral degree
- Research
- Master's degree
- Paid time off
8d

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Computational Materials and Chemistry Scientist

Applied Materials -
Bengaluru, Karnataka

Apply Now

Job details

Full-time

Benefits

Work from home

Qualifications

Law
PyTorch
MongoDB
Fortran
SQL
Machine learning
Linux
Data science
AI
Python

Full job description

Who We Are

Applied Materials is a global leader in materials engineering solutions used to produce virtually every new chip and advanced display in the world. We design, build and service cutting-edge equipment that helps our customers manufacture display and semiconductor chips – the brains of devices we use every day. As the foundation of the global electronics industry, Applied enables the exciting technologies that literally connect our world – like AI and IoT. If you want to push the boundaries of materials science and engineering to create next generation technology, join us to deliver material innovation that changes the world.

What We Offer

Location:

Bangalore,IND

You’ll benefit from a supportive work culture that encourages you to learn, develop, and grow your career as you take on challenges and drive innovative solutions for our customers. We empower our team to push the boundaries of what is possible—while learning every day in a supportive leading global company. Visit our Careers website to learn more.

At Applied Materials, we care about the health and wellbeing of our employees. We’re committed to providing programs and support that encourage personal and professional growth and care for you at work, at home, or wherever you may go. Learn more about our benefits .

Key Responsibilities:

Chemistry and materials design for screening and optimization applications with special emphasis on at least one of the following areas: polymeric materials formation and viscosity, precursor design for purity of deposition, ALD and CVD reactions of molecules in gas phase and on surfaces
Recommend atomic-scale changes to structure and/or processing conditions to influence observed properties
Scope the diverse cutting-edge materials and chemistry discovery tools on the market for potential future value and prioritize what methods warrant further exploration
Evaluate a variety of MLIP’s for validation required property prediction and potential extend to fine-tuning of MLIP’s for increased accuracy.
Explore various molecule and chemistry focused featurization and ML to determine which can add practical value to drive R&D
Hypothesize and test mechanisms to determine the root-cause of observed behavior
Work effectively with external vendor software providers in testing new features and functionality of new products
Work effectively with internal multi-disciplinary teams of experimentalists, modelers, and computing infrastructure support teams
Demonstrate analytical and engineering judgement to scope and assess the appropriate level of model required
Proactively validate/correlate results with real world data to improve models
Present complex in-depth technical material in a concise manner
Advocate for the power of modeling while also communicating limitations
Serve as a business unit chemistry, materials, or physics expert
Provide parameters, inputs, and/or guidance for higher-level process, feature, and reactor models

Background/Skills:

Extensive experience with First Principles/Ab-initio/Density Functional Theory (local orbital and plane wave), Molecular Dynamics, and/or Monte Carlo methods
Extensive experience with machine learning interatomic potentials both at the training stage and inference stage. Experience with both universal and focused approaches a plus.
Experience with polymer modeling workflows from polymer structure creation including branching and cross-linking to property prediction especially with a focus on non C-based polymers
Experience with ML/AI tools (PyTorch, scikitLearn, Chemprop, SMILES, RDKit, LLM, GNN, etc.), scripting (python, Linux), programming (C, Fortran, etc.), and databases (SQL, MongoDB, etc.)
Knowledge of informatics, artificial intelligence, machine learning, and data science approaches

Additional Information

Time Type:

Full time

Employee Type:

Assignee / Regular

Travel:

Yes, 10% of the Time

Relocation Eligible:

Yes

Applied Materials is an Equal Opportunity Employer. Qualified applicants will receive consideration for employment without regard to race, color, national origin, citizenship, ancestry, religion, creed, sex, sexual orientation, gender identity, age, disability, veteran or military status, or any other basis prohibited by law.

Apply Now

Refine Your Search

computational chemistry jobs in india

Computational Materials and Chemistry Scientist

Chemistry Research Mentor (Remote)

Scientist (Computational Chemistry / Materials & Molecular Modeling)

Scientific Manager -Computational Toxicology

Computational Chemometrics Researcher

Computational Chemometrics Researcher

Project Technical Support - III

Scientist (Bioinformatics & Computational Biology)

CA0302 - Postdoctoral Research - Computational Biology

Job Description - Internship - Insilico

Scientist (Computational Chemistry / Structural Biology & Biomolecular Modeling)

Computational Physicist Semiconductor Process Modeling

Data Scientist

Quality Assurance (QA) Engineer

Freelance – Cheminformatics & Cardiotoxicity Assessment Expert

Deputy Editor, Physical Sciences

Executive - Analytical R&D | Inhalation

Jr Product/Solutions Manager

Scientist (AI Modeling for Computational Sciences)

Research Associate I, R&D Complex Product Development

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