74 Cheminformatics Jobs

Business Context and main purpose of the job Beauty and Wellbeing (BW) is focused on Unmissable Brand Superiority and Making Market with Multi-Year Innovation Platforms and Excellence with Incremental turnover. Science & Technology (S&T) team is focused on big bets platforms such as MultiOmics, Biotechnology, Advanced Materials, using Digital to excel with savings and growth. The role of the Science and Technology (S&T-Physical and Chemical Science-PCS) is to deliver breakthrough “Differentiated & Superior Technologies” to meet above B&W goals, in key markets and with power brands. S&T-PCS team is employing Advance materials, Substrate Science and Digital to deliver Beautiful, Noticeable, Ap...

Advent Informatics Pvt Ltd, distributor of Computational Drug Discovery software solutions and services in India, is looking for talented and motivated candidates to join the team as a Junior Application Scientist. As a Junior Application Scientist, you will be focused on providing technical support and make product presentations to our customers showing interest in our product offerings. Responsibilities Online/onsite presentation (and demonstration) of our CADD/Molecular Modelling/Cheminformatics/ Scientific Data Management software suite. Provide technical and scientific support to our existing and prospective clients. Publish scientific papers and participate in conferences and seminars....

Job Summary We are seeking a highly skilled Team Lead with 7 to 11 years of experience to join our dynamic team. The ideal candidate will possess expertise in UC4 and have a strong background in Cheminformatics and Bioinformatics. This hybrid role offers the opportunity to work in a day shift providing a perfect balance between work and personal life. The candidate will play a crucial role in driving projects that impact our companys growth and contribute to advancements in the scientific community. Responsibilities Lead a team of professionals in delivering high-quality solutions in Cheminformatics and Bioinformatics. Oversee the implementation and optimization of UC4 processes to enhance o...

Job Title: Chemistry - AI Trainer Location: Remote Job Summary: Join our customer's team as a Chemistry - AI Trainer and play a pivotal role in shaping the next generation of AI-driven chemistry solutions. In this full-time, remote position, you will leverage your chemistry expertise to enhance and train AI models, ensuring precise and contextually accurate chemical knowledge. If you are passionate about science and technology, this is your chance to make a direct impact in a rapidly evolving field. Key Responsibilities: Collaborate with AI engineers and data scientists to develop and refine chemistry-related AI models. Analyze and curate chemistry datasets to enhance AI training quality and...

Role Overview: You will be joining Molecular Connections as a Senior Scientist in Chemical Data Intelligence with a focus on shaping the next-generation chemistry knowledge platform. Your role will involve leading data interpretation, developing curation protocols, and collaborating with cross-functional teams to enhance the scientific accuracy, depth, and connectivity of the database. Key Responsibilities: - Lead and review complex data extraction and curation of reactions, substances, and bioactivity data. - Design and optimize data models, taxonomies, and ontologies for chemical and experimental data. - Mentor junior scientists and oversee quality assurance of curated datasets. - Drive im...

Role Overview: At Molecular Connections, we are seeking enthusiastic chemistry graduates to join our scientific data team as Scientific Analysts. You will be responsible for transforming experimental data from scientific literature and patents into structured, searchable knowledge for our chemistry intelligence platform. This role is ideal for individuals passionate about connecting chemistry with data, technology, and research discovery. Key Responsibilities: - Extract, interpret, and curate chemical reactions, substances, and property data from journals and patents. - Annotate and validate data using internal curation tools and chemical information systems. - Ensure accuracy, consistency, ...

Dear Aspirant, TCS Hiring- Scientist for R&D in emulation/data science Location : Mumbai/ Kolkata/ Pune/Chennai Experience : 10 years overall experience, spread across a combination of manufacturing industry, consulting, information & technology services. Minimum of 5 years in IT/ Consulting Technical Skill: Modeling using molecular dynamics (MD) simulation tools such as GROMACS/Amber/OpenMD etc.; Familiarity with basic computational chemistry for organic and inorganic compounds, polymers, organometallic molecules; Understanding of ML tools as applicable to chemistry R&D including cheminformatic tools such as RDKit, MDG etc. Must have Skill : Technical Ability to work with opensource models ...

Position Purpose The role holder is responsible for collaboration & contribution to discovery programs at hit identification, lead design and optimization phase using AI/ML, cheminformatics and molecular modeling for an agrochemical industry. The role requires deep understanding of chemical, biological, scientific and statistical knowledge with past experience of its application. The role would also give an exposure to data analytics, digitalization, and exploration of new computational and AI/ML tools for research purpose. General Actively imbibing the values and philosophy of the organization and the department. Efficient contribution to the overall success of RDIT by driving innovation an...

Join us and contribute to the discovery of medicines that will impact lives! Hyderabad, India | Hybrid | Full-Time About Aganitha High-throughput experimentation, computational & data-driven modeling, and the advent of the Open Science era are fundamentally transforming research, discovery, and development across diverse industries. Aganitha is at the forefront of co-innovation with global clients, shaping next-generation R&D (aganitha.ai). While our primary client base has been in global Biopharma, we are actively expanding our collaborations into consumer brands and, in the near future, the materials design industry. As a Scientist at Aganitha, you will be instrumental in leveraging cuttin...

Date: 17 Sept 2025 Location: Bangalore, KA, IN, 560100 Custom Field 1: Essential Functions Role Overview We are seeking a highly motivated Data Scientist to support advanced analytics initiatives across the organization. Key Responsibilities Manage end-to-end analytics projects including data wrangling, model development, validation, and deployment. Collaborate with scientific and operational teams to identify opportunities for data science applications in drug discovery, development, and manufacturing. Interact with domain experts and clients to understand data, business challenges and implement robust, scalable solutions. Design and implement machine learning models, statistical analyses, ...

Job Summary We are seeking a skilled Test Analyst with 5 to 7 years of experience to join our team in a hybrid work model. The ideal candidate will have expertise in automated and manual testing data migration and AWS IoT. Experience in data models cheminformatics R&D and preclinical & clinical domains is a plus. This role involves ensuring the quality and reliability of our software solutions contributing to impactful projects that advance our companys mission. Responsibilities Conduct comprehensive automated testing to ensure software quality and reliability. Perform manual testing to identify and resolve defects in software applications. Oversee data migration processes to ensure seamless...

Position Purpose The role holder is responsible for collaboration & contribution to discovery programs at hit identification, lead design and optimization phase using AI/ML, cheminformatics and molecular modeling for an agrochemical industry. The role requires deep understanding of chemical, biological, scientific and statistical knowledge with past experience of its application. The role would also give an exposure to data analytics, digitalization, and exploration of new computational and AI/ML tools for research purpose. General Actively imbibing the values and philosophy of the organization and the department. Efficient contribution to the overall success of RDIT by driving innovation an...

Key Responsibilities Design and implement computational workflows for chemical, biological, and multi-omics data analysis. Apply cheminformatics techniques (virtual screening, molecular docking, QSAR, ADMET modeling) to support lead identification and optimization. Analyze next-generation sequencing (NGS), RNA-seq, proteomics, and single-cell datasets to identify biomarkers, pathways, and novel targets. Integrate chemical libraries with biological and clinical datasets for cross-domain insights. Understanding of protein-protein interaction, ADC and PDC development. Develop and apply machine learning/AI models for predictive drug discovery and biomarker discovery. Collaborate closely with med...

Key Responsibilities JOB DESCRIPTION Design and implement computational workflows for chemical, biological, and multi-omics data analysis. Apply cheminformatics techniques (virtual screening, molecular docking, QSAR, ADMET modeling) to support lead identification and optimization. Analyze next-generation sequencing (NGS), RNA-seq, proteomics, and single-cell datasets to identify biomarkers, pathways, and novel targets. Integrate chemical libraries with biological and clinical datasets for cross-domain insights. Understanding of protein-protein interaction, ADC and PDC development. Develop and apply machine learning/AI models for predictive drug discovery and biomarker discovery. Collaborate ...

We are seeking a Sr. Functional Architect with 12 to 16 years of experience to join our team. The ideal candidate will possess expertise in SAP APO modules and domain skills in Cheminformatics and Bioinformatics. This hybrid role requires a strategic thinker who can drive innovation and efficiency in our processes. The position offers an opportunity to make a significant impact on our companys success and contribute to advancements in the industry. Responsibilities Lead the design and implementation of SAP APO solutions to optimize supply chain processes. Oversee the integration of SAP APO modules including Service Parts Planning GATP Demand Planning SNP and PP-DS. Provide expert guidance on...

A Day in Your Life at MKS: As an Application Developer, Data Analytics at MKS MSD, you will collaborate closely with the Data Analytics team to support ELN, Spotfire, and related initiatives. Reporting to the Data Analytics Team Manager, you will apply various methods and strategies to assist multiple departments across the organization. This role involves working alongside your immediate team, the team manager, R&D manager, and other cross-functional groups. Open, clear communication with both the team and R&D managers is essential. You’ll be encouraged to take initiative, propose your own ideas, and develop effective approaches to successfully carry out your responsibilities. You Will Make...

Skill Sets: Deep Learning, GenAI, Agentic AI, Publications/Prototyping Role Overview Develop and deploy deep learning, generative AI, and agentic AI solutions for drug discovery and pharmaceutical research. Onsite position . Responsibilities Build deep learning models for molecular design, drug discovery, and protein analysis Develop generative AI systems for molecule generation and lead optimization Create agentic AI solutions to automate scientific workflows Prototype and deploy AI applications for pharmaceutical challenges Collaborate with chemists and biologists; publish/present findings Requirements Bachelor's degree in Computer Science, Bioinformatics, Data Science, or related field St...

A Day in Your Life at MKS: As an Application Developer, Data Analytics at MKS MSD, you will collaborate closely with the Data Analytics team to support ELN, Spotfire, and related initiatives. Reporting to the Data Analytics Team Manager, you will apply various methods and strategies to assist multiple departments across the organization. This role involves working alongside your immediate team, the team manager, R&D manager, and other cross-functional groups. Open, clear communication with both the team and R&D managers is essential. You’ll be encouraged to take initiative, propose your own ideas, and develop effective approaches to successfully carry out your responsibilities. You Will Make...

As a Lead Consultant - Cheminformatics Engineer at AstraZeneca, you will play a crucial role in redefining the industry and changing lives by working with a team of highly skilled scientists in Early Science. Your responsibilities will include: - Being a domain expert with knowledge of cheminformatics and computational chemistry tools used in drug discovery. - Working with groundbreaking technology stacks in a cloud environment to solve scientific challenges for drug discovery. - Designing and implementing scientific software and data solutions to enhance ease, learning, delivery speed, and quality across all therapeutic areas. - Creating novel products and features to address long-standing ...

Position Overview We are seeking a highly skilled and motivated Team Leader with expertise in AI-driven drug discovery, deep learning, and computational chemistry to lead a cross-disciplinary research team. The successful candidate will guide the design, development, and application of advanced AI/ML models for accelerating drug discovery, molecular design, and therapeutic development. This role requires both technical leadership and strategic vision to drive innovation in pharmaceutical R&D. Key Responsibilities · Leadership & Strategy o Lead, mentor, and grow a team of AI scientists, computational chemists, and data engineers. o Define research strategy and align project milestones with or...

Role Overview: As an Infrastructure Technology Consultant, you will be responsible for designing and implementing scalable infrastructure solutions using Azure to support scientific research projects. Your expertise in Azure Cosmos DB, MySQL, and MS SQL Server will be crucial in optimizing database performance and managing data storage solutions. In this hybrid role, you will collaborate with cross-functional teams to integrate cheminformatics and bioinformatics data into existing systems and ensure the reliability and security of our infrastructure. Key Responsibilities: - Monitor system performance, troubleshoot issues, and minimize downtime to enhance efficiency. - Develop and maintain do...

Job Title: Chemistry - AI Trainer (MSc. or PhD) Job Type: Part-time Location: Remote Job Summary: Join our customer's team as a Chemistry - AI Trainer and play a pivotal role in shaping the next generation of AI-driven chemistry solutions. In this full-time, remote position, you will leverage your chemistry expertise to enhance and train AI models, ensuring precise and contextually accurate chemical knowledge. If you are passionate about science and technology, this is your chance to make a direct impact in a rapidly evolving field. Key Responsibilities: Collaborate with AI engineers and data scientists to develop and refine chemistry-related AI models. Analyze and curate chemistry datasets ...

Job Title: Chemistry - AI Trainer (MSc. or PhD) Job Type: Part-time Location: Remote Job Summary: Join our customer's team as a Chemistry - AI Trainer and play a pivotal role in shaping the next generation of AI-driven chemistry solutions. In this full-time, remote position, you will leverage your chemistry expertise to enhance and train AI models, ensuring precise and contextually accurate chemical knowledge. If you are passionate about science and technology, this is your chance to make a direct impact in a rapidly evolving field. Key Responsibilities: Collaborate with AI engineers and data scientists to develop and refine chemistry-related AI models. Analyze and curate chemistry datasets ...

Job Summary As a Senior Consultant you will leverage your expertise in Contracts and Agreements along with iCertis to provide strategic insights and solutions in the Cheminformatics and Bioinformatics domains. Working in a hybrid model you will collaborate with cross-functional teams to enhance business processes and drive innovation. Your role will significantly contribute to the companys mission of advancing scientific research and development. Responsibilities Lead the analysis and interpretation of complex contracts and agreements to ensure compliance and alignment with business objectives. Oversee the implementation of iCertis solutions to streamline contract management processes and im...

Position Overview We are seeking a highly skilled and motivated Team Leader with expertise in AI-driven drug discovery, deep learning, and computational chemistry to lead a cross-disciplinary research team. The successful candidate will guide the design, development, and application of advanced AI/ML models for accelerating drug discovery, molecular design, and therapeutic development. This role requires both technical leadership and strategic vision to drive innovation in pharmaceutical R&D. --- Key Responsibilities · Leadership & Strategy o Lead, mentor, and grow a team of AI scientists, computational chemists, and data engineers. o Define research strategy and align project milestones wit...