Materials Informatics Market

Materials Informatics Market Forecast and Outlook 2025 to 2035

The global materials informatics market is projected to reach USD 1,137.8 million by 2035, recording an absolute increase of USD 931.1 million over the forecast period. The market is valued at USD 208.4 million in 2025 and is set to rise at a CAGR of 18.5% during the assessment period.

The overall market size is expected to grow by nearly 5.5 times during the same period, supported by increasing demand for advanced AI and machine learning technologies in materials discovery, expanding chemical industries applications, and growing adoption of computational methods in materials science across global research and development facilities. Market expansion faces constraints from high computational infrastructure costs and technical complexity requirements in advanced materials modeling applications.

Quick Stats for Materials Informatics Market

• Materials Informatics Market Value (2025): USD 208.4 million
• Materials Informatics Market Forecast Value (2035): USD 1,137.8 million
• Materials Informatics Market Forecast CAGR: 18.5%
• Leading Deployment Type in Materials Informatics Market: Cloud-based (51.2%)
• Key Growth Regions in Materials Informatics Market: China, India, South Korea, Japan
• Top Key Players in Materials Informatics Market: Citrine Informatics, Materials Project, Schrödinger Inc., BIOVIA, QuesTek Innovations LLC

Materials Informatics Market Year-over-Year Forecast 2025 to 2035

Between 2025 and 2030, the materials informatics market is projected to expand from USD 208.4 million to USD 485.7 million, resulting in a value increase of USD 277.3 million, which represents 29.8% of the total forecast growth for the decade. This phase of growth will be shaped by rising demand for advanced computational materials discovery solutions, product innovation in digital annealer systems and deep learning technologies, and expanding applications across chemical industries and electronics semiconductor sectors. Companies are establishing competitive positions through investment in AI and machine learning technology development, strategic partnerships with research institutions, and market expansion across pharmaceutical companies, materials manufacturers, and emerging nanotechnology research facilities.

From 2030 to 2035, the market is forecast to grow from USD 485.7 million to USD 1,137.8 million, adding another USD 653.8 million, which constitutes 70.2% of the overall ten-year expansion. This period is expected to be characterized by expansion of specialized informatics solutions including quantum annealing systems and tensor network platforms tailored for specific materials applications, strategic collaborations between technology providers and materials research organizations, and enhanced integration with cloud-based platforms and artificial intelligence systems. The growing emphasis on sustainable materials development and advanced composite materials will drive demand for sophisticated materials informatics capabilities across diverse chemical and electronics applications.

Materials Informatics Market Key Takeaways

Metric	Value
Market Value (2025)	USD 208.4 million
Market Forecast Value (2035)	USD 1,137.8 million
Forecast CAGR (2025-2035)	18.5%

Materials Informatics Market Opportunity Pools

The Materials Informatics market is entering a technology-driven expansion phase, driven by demand for advanced computational chemistry, expanding pharmaceutical research, and evolving artificial intelligence standards across materials science. By 2035, these pathways together can unlock USD 1,400-1,800 million in incremental revenue opportunities beyond baseline growth.

• Pathway A - Chemical Industries Leadership (Pharmaceutical Research) The chemical industries segment already holds the largest share due to its critical role in pharmaceutical discovery and chemical manufacturing. Expanding high-precision computational capabilities, automated research workflows, and specialized pharmaceutical-grade systems can consolidate leadership. Opportunity pool: USD 420-540 million.
• Pathway B - Digital Annealer Dominance (Quantum Computing) Digital annealer systems account for significant market demand. Growing requirements for computational efficiency and quantum capabilities, especially in advanced materials research, will drive higher adoption of quantum computing platforms. Opportunity pool: USD 350-450 million.
• Pathway C - China & India Market Expansion (Research Infrastructure Growth) China and India present the highest growth potential with CAGRs of 24.8% and 23.7% respectively. Targeting expanding research infrastructure and government science initiatives will accelerate adoption. Opportunity pool: USD 280-360 million.
• Pathway D - Cloud-based Deployment (Collaborative Research) Cloud-based platforms represent majority market share with growing collaborative research requirements and distributed computing needs. Opportunity pool: USD 200-260 million.
• Pathway E - Artificial Intelligence Integration Advanced AI integration, machine learning algorithms, and automated discovery capabilities create opportunities for next-generation computational solutions with enhanced intelligence and automation. Opportunity pool: USD 140-180 million.
• Pathway F - Electronics Semiconductor Expansion (Advanced Materials) Systems optimized for semiconductor research, electronic materials discovery, and device optimization offer premium positioning for high-technology market segments. Opportunity pool: USD 120-156 million.
• Pathway G - Multi-technique Flexibility Advanced computational platforms capable of handling multiple techniques, materials types, and research requirements can capture growing demand for research versatility. Opportunity pool: USD 100-130 million.
• Pathway H - Research Services and Support Revenue Comprehensive service packages including computational consulting, research collaboration, and technical training create long-term revenue streams across global research operations. Opportunity pool: USD 80-104 million.

Why is the Materials Informatics Market Growing?

The materials informatics market grows by enabling research institutions and materials companies to achieve superior materials discovery performance that enhances computational efficiency and accelerates development timelines in advanced materials applications. Demand drivers include expanding chemical industries requiring advanced materials discovery technologies, increasing electronics semiconductor applications for next-generation device development and manufacturing optimization, and growing adoption in pharmaceutical drug discovery where materials informatics supports enhanced molecular design and optimization.

Priority segments include materials research organizations and chemical manufacturing companies, with China and India representing key growth geographies due to expanding research and development capabilities and increasing materials science investments. Market growth faces constraints from high computational infrastructure costs and the need for specialized data science expertise to optimize informatics parameters for different applications.

Segmental Analysis

The market is segmented by technique, material, application, deployment, and region. By technique, the market is divided into digital annealer, statistical analysis, deep tensor, and genetic algorithm systems. By material, the market is categorized into chemicals, superalloys, solid-state electrolytes, and composites.

By application, the market includes chemical industries, materials discovery, product development, and electronics semiconductor. By deployment, the market is segmented into cloud-based and on-premise solutions. Regionally, the market is divided into North America, Latin America, Europe, East Asia, South Asia & Pacific, and Middle East & Africa.

By Technique, Digital Annealer Segment Accounts for Significant 37.6% Market Share

Digital annealer materials informatics systems are projected to account for a substantial portion of 37.6% of the materials informatics market in 2025. This share is supported by enhanced computational efficiency capabilities and superior optimization characteristics.

Digital annealer systems provide reliable materials modeling performance with advanced quantum computing capabilities that enable complex materials discovery and reduced computational time requirements. The segment enables stakeholders to benefit from improved research productivity and standardized computational outcomes for demanding materials science applications.

The dominance of digital annealer systems reflects the materials science industry's increasing focus on computational precision and research efficiency. These advanced systems incorporate sophisticated quantum annealing algorithms, real-time optimization monitoring, and automated materials screening capabilities that eliminate traditional computational limitations while ensuring consistent modeling parameters across research projects.

Research organizations operating in high-complexity environments particularly benefit from the reduced computational requirements and enhanced discovery capabilities that digital annealer systems provide. The integration of quantum computing technologies, including quantum annealing and hybrid classical-quantum approaches, further strengthens the value proposition of digital annealer systems by enabling breakthrough materials discovery and predictive materials design.

Stringent accuracy requirements in materials research demand the precise computational control that only digital annealer systems can deliver consistently. As research complexity continues to scale and discovery standards become more demanding, the preference for digital annealer systems is expected to intensify, particularly among large-scale research institutions seeking to optimize their computational efficiency while maintaining the highest accuracy standards in materials informatics applications. Within the digital annealer segment, quantum annealing holds a leading share of 19.8%, followed by classical annealing at 17.8%.

Key factors supporting digital annealer system adoption:

• Enhanced computational throughput and consistency suitable for high-complexity materials modeling
• Advanced quantum optimization capabilities ensuring reliable discovery quality

By Material, Chemicals Segment Accounts for 34.7% Dominant Market Share

Chemicals applications are expected to represent the largest share of 34.7% of the materials informatics market materials in 2025. This dominant share reflects the critical need for advanced computational modeling solutions in chemical research that appeals to pharmaceutical companies and chemical manufacturers. The segment provides essential discovery support for complex chemical compounds requiring superior molecular design and long-term stability analysis. Growing demand for drug discovery and catalyst design drives adoption in this application area.

The chemicals segment's market leadership stems from the fundamental transformation occurring in the global pharmaceutical and chemical manufacturing sectors. Drug discovery applications are creating unprecedented demand for computational chemistry tools that can handle complex molecular interactions while maintaining accuracy over extended research periods. Materials informatics technology has emerged as the preferred modeling method for these applications due to its superior predictive capabilities compared to traditional experimental approaches. The technology enables researchers to create robust molecular models that effectively predict chemical behavior and optimize compound properties, thereby improving research efficiency and extending discovery timelines.

Furthermore, catalyst design systems, including industrial catalysts and renewable energy applications, require chemical modeling tools capable of operating efficiently under demanding computational conditions. The expanding deployment of sustainable chemistry initiatives also drives demand for advanced chemical modeling systems that rely on materials informatics technology.

Industrial applications, including polymer development and specialty chemicals, represent additional growth opportunities where the superior predictive performance of materials informatics provides competitive advantages in research productivity and development optimization. Within the chemicals segment, polymers command a leading share of 18.9%, followed by organic compounds at 15.8%.

Chemicals segment advantages include:

• Critical role in pharmaceutical drug discovery and chemical manufacturing development
• Wide application across research, industrial, and specialty chemicals requiring high computational performance

By Application, Chemical Industries Segment Accounts for 29.8% Dominant Market Share

Chemical industries applications are expected to represent the largest share of 29.8% of the materials informatics market applications in 2025. This dominant share reflects the critical need for advanced computational modeling solutions in chemical research and manufacturing that appeals to pharmaceutical companies and chemical manufacturers. The segment provides essential research support for complex chemical processes requiring superior molecular analysis and optimization capabilities. Growing demand for drug discovery and catalyst design drives adoption in this application area.

The chemical industries segment's market leadership stems from the fundamental digital transformation occurring in the global chemical and pharmaceutical sectors. Drug discovery applications are creating unprecedented demand for computational chemistry platforms that can handle complex molecular screening while maintaining research accuracy over extended development cycles.

Materials informatics technology has emerged as the preferred research method for these applications due to its superior predictive modeling capabilities compared to traditional laboratory-based approaches. The technology enables researchers to create comprehensive molecular databases that effectively analyze chemical properties and optimize compound development, thereby improving research efficiency and accelerating discovery timelines.

Furthermore, catalyst design applications, including industrial process optimization and sustainable chemistry initiatives, require computational modeling tools capable of operating efficiently under demanding research conditions. The expanding deployment of green chemistry programs and environmental sustainability requirements also drive demand for advanced chemical modeling systems that rely on materials informatics capabilities. Industrial applications, including specialty chemicals and advanced materials development, represent additional growth opportunities where the superior analytical performance of materials informatics provides competitive advantages in research productivity and development optimization. Within the chemical industries segment, drug discovery holds a leading share of 16.4%, followed by catalyst design at 13.4%.

Chemical Industries segment advantages include:

• Critical role in pharmaceutical research and chemical manufacturing optimization
• Wide application across research institutions, pharmaceutical companies, and chemical manufacturers requiring high computational performance

By Deployment, Cloud-based Segment Accounts for 51.2% Market Share

Cloud-based materials informatics systems are projected to account for 51.2% of the materials informatics market deployment in 2025. This share is supported by enhanced scalability capabilities and cost-effective infrastructure characteristics. Cloud-based systems provide flexible computational resources with advanced data processing capabilities that enable distributed research collaboration and reduced hardware investment requirements. The segment enables stakeholders to benefit from improved accessibility and standardized platform outcomes for demanding computational applications.

The cloud-based deployment model's market leadership reflects the research community's increasing focus on collaborative efficiency and resource optimization. These advanced cloud platforms incorporate sophisticated distributed computing architectures, real-time data synchronization, and automated scaling capabilities that eliminate traditional hardware limitations while ensuring consistent computational performance across research teams.

Research organizations operating in collaborative environments particularly benefit from the reduced infrastructure requirements and enhanced accessibility that cloud-based systems provide. The integration of artificial intelligence services, including machine learning platforms and automated analysis tools, further strengthens the value proposition of cloud-based systems by enabling advanced computational capabilities without significant capital investment.

Additionally, the growing requirements for data sharing and collaborative research demand the flexible access that only cloud-based systems can deliver consistently. As research collaboration continues to expand and computational demands become more sophisticated, the preference for cloud-based systems is expected to intensify, particularly among distributed research teams seeking to optimize their computational resources while maintaining high performance standards in materials informatics applications.

Key factors supporting cloud-based deployment adoption:

• Enhanced scalability and accessibility suitable for collaborative research environments
• Cost-effective infrastructure reducing capital investment requirements

What are the Drivers, Restraints, and Key Trends of the Materials Informatics Market?

Market drivers include expanding pharmaceutical development requiring advanced computational chemistry platforms, increasing electronics semiconductor applications where materials modeling demands superior predictive capabilities, and growing adoption in chemical industries manufacturing where materials informatics supports enhanced discovery efficiency and development acceleration. These drivers reflect direct research outcomes including improved computational accuracy, enhanced discovery speed, and extended research capabilities across multiple materials science applications.

Market restraints encompass high computational infrastructure investments that limit adoption among smaller research facilities, technical complexity requiring specialized data science expertise and advanced modeling knowledge, and long research validation cycles for critical applications that slow market penetration. Additional constraints include integration challenges with existing research workflows and the need for continuous algorithm optimization that increases operational complexity and maintenance requirements.

Key trends show adoption accelerating in China and India where expanding materials research and computational science capabilities drive demand, while technology shifts toward artificial intelligence integration and machine learning platforms enable broader market access. Technology advancement focuses on enhanced quantum computing integration and multi-application flexibility that expand modeling possibilities across demanding materials science applications. Market thesis faces risk from alternative computational technologies that could provide similar research performance at lower costs or with simplified implementation requirements.

Analysis of Materials Informatics Market by Key Country

Country	CAGR (2025-2035)
China	24.8%
India	23.7%
South Korea	22.4%
Japan	21.3%
Germany	20.1%
U.S.	19.8%
U.K.	18.9%

The materials informatics market shows strong growth dynamics across key countries from 2025-2035. China leads globally with a CAGR of 24.8%, fueled by massive research and development expansion, government materials science initiatives, and growing computational chemistry capabilities. India follows closely at 23.7%, driven by increasing research infrastructure, computational science operations, and strong government support for domestic technology development. South Korea maintains strong growth with 22.4%, leveraging its advanced electronics sector and established semiconductor research infrastructure. Japan records 21.3%, reflecting opportunities in electronics applications and materials research despite mature market conditions. Germany maintains solid expansion at 20.1%, supported by advanced chemical industries and established materials research infrastructure. Growth in the United States (19.8%) and United Kingdom (18.9%) remains strong, backed by established research institutions and technology companies, though comparatively slower than emerging research markets.

The report covers an in-depth analysis of 40+ countries; 7 top-performing countries are highlighted below.

China Leads Global Materials Informatics Market Growth

China demonstrates the strongest growth potential in the materials informatics market with its expanding research and development sector and substantial government investment in computational science technologies. The market is projected to grow at a CAGR of 24.8% through 2035, driven by increasing materials research activities, expanding pharmaceutical development, and growing adoption across research institutions in Beijing, Shanghai, and Shenzhen. Chinese research organizations are adopting materials informatics systems for advanced discovery applications and computational chemistry research, with particular emphasis on artificial intelligence integration and research efficiency optimization. Government support for technological self-sufficiency and materials science development expand deployment across chemical research and pharmaceutical development.

• Leading research institutions driving advanced computational equipment demand
• Government science initiatives supporting domestic materials research capabilities

India Emerges as Key Growth Market for Research Technology Equipment

India's materials informatics market reflects strong potential based on expanding research infrastructure and increasing computational science operations. The market is projected to grow at a CAGR of 23.7% through 2035, with growth accelerating through cost-effective research strategies under quality and performance constraints, particularly in pharmaceutical research and materials discovery applications in Bangalore, Mumbai, and Delhi. Indian research institutions and pharmaceutical companies are adopting materials informatics systems for advanced discovery applications and computational modeling solutions, with growing emphasis on cloud-based platforms and research collaboration. Strategic partnerships with international technology suppliers expand access to advanced computational technologies and technical support.

• Research infrastructure and pharmaceutical development operations gaining prominence
• Government research initiatives facilitating advanced technology adoption

South Korea Maintains Strong Position in Advanced Technology Markets

South Korea demonstrates established strength in the materials informatics market through its advanced electronics sector and robust research infrastructure. The market shows strong growth at a CAGR of 22.4% through 2035, with established electronics companies and research institutions driving demand in Seoul, Daejeon, and Busan. South Korean manufacturers focus on high-precision computational applications and electronics research, particularly in semiconductor materials requiring sophisticated computational modeling solutions. The country's strong technology capabilities and established research partnerships support consistent market development across multiple application areas.

• Electronics research and semiconductor development driving precision computational requirements
• Established research expertise supporting market growth and innovation

Japan Focuses on Electronics and Materials Research Applications

Japan's materials informatics market shows significant growth potential at a CAGR of 21.3% through 2035, driven by expanding electronics research and advanced materials applications. The market benefits from increasing semiconductor research and computational chemistry development, with particular strength in research institution networks. Japanese research organizations and technology companies adopt materials informatics systems for materials discovery and computational analysis applications, addressing both performance and accuracy requirements. Market development benefits from growing technology industry modernization and expanding research capabilities.

• Electronics research and advanced materials driving demand for computational technologies
• Research institution networks supporting market expansion across materials applications

Germany Leverages Advanced Chemical Research Infrastructure

Germany maintains strong growth in the materials informatics market through its established chemical industry and advanced research capabilities. Market expansion at a CAGR of 20.1% through 2035 reflects consistent demand from chemical manufacturers, research institutions, and pharmaceutical companies requiring advanced computational capabilities. German research organizations utilize materials informatics systems across chemical research, pharmaceutical development, and materials discovery applications, with particular emphasis on research optimization and computational efficiency. The country's strong technology development programs and established research networks support stable market conditions and continued innovation advancement.

• Chemical research and pharmaceutical development maintaining steady technology demand
• Research programs supporting computational capability enhancement and innovation

United States Shows Consistent Advanced Research Development

The United States demonstrates consistent progress in the materials informatics market with a CAGR of 19.8% through 2035, supported by established research institutions and technology developers. American research organizations and pharmaceutical companies adopt materials informatics systems for advanced discovery and computational modeling applications, with particular focus on research precision and quality control capabilities. The market benefits from strong research partnerships and established relationships with technology suppliers. Development remains steady across multiple research applications despite economic uncertainties affecting research investment levels.

• Research institutions and pharmaceutical development driving consistent technology demand
• Technology partnerships supporting computational capability development

United Kingdom Maintains Stable Advanced Research Technology Market

The United Kingdom's materials informatics market shows steady development with a CAGR of 18.9% through 2035, as established research institutions and pharmaceutical companies maintain consistent demand. Market growth reflects mature market conditions and established computational research capabilities across pharmaceutical and chemical sectors. British research organizations and technology companies utilize materials informatics systems for high-precision discovery applications and advanced computational solutions, particularly in pharmaceutical research and chemical modeling. The market benefits from domestic technology expertise and strong technical support infrastructure, though growth remains moderate compared to emerging research markets.

• Research precision and pharmaceutical development requiring advanced computational capabilities
• Domestic technology providing innovation and service infrastructure

Competitive Landscape of Materials Informatics Market

The materials informatics market operates with a moderately concentrated structure featuring approximately 12-15 meaningful players, with the top five companies holding roughly 60-65% market share. Competition centers on technological capabilities, computational features, and comprehensive research support rather than price competition alone. Market leaders include Citrine Informatics with 16.8% market share, Materials Project, and Schrödinger Inc., which maintain competitive positions through established technology development capabilities, comprehensive platform portfolios, and strong research support networks. These companies benefit from scale advantages in software development, extensive computational expertise, and established relationships with key research institutions and pharmaceutical companies worldwide.

Challenger companies include BIOVIA (Dassault Systèmes) and QuesTek Innovations LLC, which compete through specialized computational solutions and research focus, particularly in specific application areas or technology segments. These companies differentiate through innovative algorithm technologies, competitive platform pricing strategies, and targeted research service approaches. Granta Design (ANSYS), Materials Design Inc., AFLOW, and Kebotix represent additional significant players with established presence in computational chemistry markets and strong technical capabilities in materials modeling and discovery technologies.

Competition intensifies around algorithm innovation, with companies investing in advanced machine learning systems, enhanced quantum computing integration, and comprehensive data analytics platforms that improve research efficiency and discovery accuracy. Market dynamics reflect the importance of technical support services, research collaboration programs, and ongoing platform development that influence customer adoption decisions. Strategic partnerships with research institutions and pharmaceutical companies shape competitive positioning across different regional markets and application segments.

Key Players in the Materials Informatics Market

• Citrine Informatics
• Materials Project
• Schrödinger Inc.
• BIOVIA (Dassault Systèmes)
• QuesTek Innovations LLC
• Granta Design (ANSYS)
• Materials Design Inc.
• AFLOW
• Kebotix

Scope of the Report

Item	Value
Quantitative Units	USD 208.4 million
Technique	Digital Annealer, Statistical Analysis, Deep Tensor, Genetic Algorithm
Material	Chemicals, Superalloys, Solid-state Electrolytes, Composites
Application	Chemical Industries, Materials Discovery, Product Development, Electronics & Semiconductor
Deployment	Cloud-based, On-premise
Regions Covered	North America, Latin America, Europe, East Asia, South Asia & Pacific, Middle East & Africa
Country Covered	China, India, South Korea, Japan, Germany, United States, United Kingdom, and 40+ additional countries
Key Companies Profiled	Citrine Informatics, Materials Project, Schrödinger Inc., BIOVIA, QuesTek Innovations LLC, Granta Design, Materials Design Inc., AFLOW, Kebotix

Materials Informatics Market by Segments

• Technique :

  • Digital Annealer
  • Statistical Analysis
  • Deep Tensor
  • Genetic Algorithm

• Material :

  • Chemicals
  • Superalloys
  • Solid-state Electrolytes
  • Composites

• Application :

  • Chemical Industries
  • Materials Discovery
  • Product Development
  • Electronics & Semiconductor

• Deployment :

  • Cloud-based
  • On-premise

• Region :

  • North America
    • United States
    • Canada
    • Mexico
  • Europe
    • Germany
    • United Kingdom
    • France
    • Italy
    • Spain
    • Netherlands
    • Switzerland
    • BENELUX
    • Rest of Europe
  • East Asia
    • China
    • Japan
    • South Korea
  • South Asia & Pacific
    • India
    • ASEAN
    • Australia & New Zealand
    • Rest of South Asia & Pacific
  • Latin America
    • Brazil
    • Chile
    • Rest of Latin America
  • Middle East & Africa
    • Kingdom of Saudi Arabia
    • Other GCC Countries
    • Turkiye
    • South Africa
    • Other African Union
    • Rest of Middle East & Africa