

The Molecular Modelling Software market is a critical component of the broader computational chemistry industry, providing tools for simulating and analyzing the structures, dynamics, and interactions of molecules. This software is used in a wide range of fields, including drug discovery, materials science, biotechnology, and environmental science.
The global Molecular Modelling Software market size is projected to grow from US$ 324 million in 2024 to US$ 441 million in 2030; it is expected to grow at a CAGR of 5.3% from 2024 to 2030.
LPI (publisher)' newest research report, the “Molecular Modelling Software Industry Forecast” looks at past sales and reviews total world Molecular Modelling Software sales in 2022, providing a comprehensive analysis by region and market sector of projected Molecular Modelling Software sales for 2023 through 2029. With Molecular Modelling Software sales broken down by region, market sector and sub-sector, this report provides a detailed analysis in US$ millions of the world Molecular Modelling Software industry.
This Insight Report provides a comprehensive analysis of the global Molecular Modelling Software landscape and highlights key trends related to product segmentation, company formation, revenue, and market share, latest development, and M&A activity. This report also analyses the strategies of leading global companies with a focus on Molecular Modelling Software portfolios and capabilities, market entry strategies, market positions, and geographic footprints, to better understand these firms’ unique position in an accelerating global Molecular Modelling Software market.
This Insight Report evaluates the key market trends, drivers, and affecting factors shaping the global outlook for Molecular Modelling Software and breaks down the forecast by Type, by Application, geography, and market size to highlight emerging pockets of opportunity. With a transparent methodology based on hundreds of bottom-up qualitative and quantitative market inputs, this study forecast offers a highly nuanced view of the current state and future trajectory in the global Molecular Modelling Software.
Here are some key trends in the Molecular Modelling Software market:
Advanced Simulation Capabilities: Software is becoming more sophisticated, allowing for the simulation of larger and more complex molecular systems with greater accuracy and detail. This includes the ability to simulate molecular dynamics over longer timescales and at higher resolutions.
Integration with AI and Machine Learning: Molecular modelling software is increasingly integrating artificial intelligence (AI) and machine learning (ML) algorithms to improve the efficiency and accuracy of virtual screening, docking, and drug design processes.
Cloud-Based Solutions: As with other industries, cloud-based molecular modelling software is gaining popularity due to its scalability, cost-effectiveness, and ease of access. It allows users to tap into powerful computing resources without the need for extensive on-site infrastructure.
User-Friendly Interfaces: There is a shift towards making molecular modelling software more accessible to users who may not have a background in computational chemistry. This includes the development of more intuitive interfaces and workflow automation.
Open-Source Software: Open-source molecular modelling software continues to gain traction, driven by its flexibility, community-driven development, and cost savings. Platforms like GROMACS, AMBER, and CHARMM are widely used and contribute to the overall growth of the market.
Platform and Application Specialization: Software providers are developing specialized platforms for specific applications, such as drug discovery, materials design, or biophysics. These specialized tools often come with curated databases and optimized algorithms for the particular application.
Regulatory Compliance: As the pharmaceutical and biotechnology industries are highly regulated, molecular modelling software needs to comply with various regulatory standards, such as those set by the FDA and EMA.
Predictive Analytics: Advanced molecular modelling software is being used more frequently for predictive analytics, forecasting the behavior of molecules under different conditions or the outcomes of chemical reactions.
Collaborative Research Tools: Molecular modelling software is evolving to include features that facilitate collaborative research, allowing multiple users to work on the same project simultaneously and share data and simulations.
Integration with Experimental Data: The trend towards integrating computational models with experimental data is growing, creating a more iterative process between simulation and experimentation.
This report presents a comprehensive overview, market shares, and growth opportunities of Molecular Modelling Software market by product type, application, key players and key regions and countries.
Segmentation by Type:
On-Premise
Cloud-Based
Segmentation by Application:
Drug Discovery
Materials Science
Biotechnology
Environmental Science
Others
This report also splits the market by region:
Americas
United States
Canada
Mexico
Brazil
APAC
China
Japan
Korea
Southeast Asia
India
Australia
Europe
Germany
France
UK
Italy
Russia
Middle East & Africa
Egypt
South Africa
Israel
Turkey
GCC Countries
Segmentation by Type:
On-Premise
Cloud-Based
Segmentation by Application:
Drug Discovery
Materials Science
Biotechnology
Environmental Science
Others
This report also splits the market by region:
Americas
United States
Canada
Mexico
Brazil
APAC
China
Japan
Korea
Southeast Asia
India
Australia
Europe
Germany
France
UK
Italy
Russia
Middle East & Africa
Egypt
South Africa
Israel
Turkey
GCC Countries
The below companies that are profiled have been selected based on inputs gathered from primary experts and analyzing the company's coverage, product portfolio, its market penetration.
ANSYS, Inc (U.S.)
Frontline Data Solutions (U.S.)
FindMolecule (Canada)
Metso (Finland)
eLogger (U.S.)
Chemstations Inc. (U.S.)
deepmatter Group Limited (Germany)
Antipodes Scientific Ltd. (New Zealand)
Vicinity (U.S.)
Sivco Inc. (U.S.)
Labcup, Ltd. (U.K.)
QIAGEN (Germany)
Alchemy Cloud, Inc. (U.S.)
YASH Technologies (U.S.)
Yordas Limited (U.K.)
Kintech Lab (Russia)
Hypercube, Inc. (U.S.)
Please Note - This is an on demand report and will be delivered in 2 business days (48 hours) post payment.
1 Scope of the Report
1.1 Market Introduction
1.2 Years Considered
1.3 Research Objectives
1.4 Market Research Methodology
1.5 Research Process and Data Source
1.6 Economic Indicators
1.7 Currency Considered
1.8 Market Estimation Caveats
2 Executive Summary
2.1 World Market Overview
2.1.1 Global Molecular Modelling Software Market Size 2019-2030
2.1.2 Molecular Modelling Software Market Size CAGR by Region (2019 VS 2023 VS 2030)
2.1.3 World Current & Future Analysis for Molecular Modelling Software by Country/Region, 2019, 2023 & 2030
2.2 Molecular Modelling Software Segment by Type
2.2.1 On-Premise
2.2.2 Cloud-Based
2.3 Molecular Modelling Software Market Size by Type
2.3.1 Molecular Modelling Software Market Size CAGR by Type (2019 VS 2023 VS 2030)
2.3.2 Global Molecular Modelling Software Market Size Market Share by Type (2019-2024)
2.4 Molecular Modelling Software Segment by Application
2.4.1 Drug Discovery
2.4.2 Materials Science
2.4.3 Biotechnology
2.4.4 Environmental Science
2.4.5 Others
2.5 Molecular Modelling Software Market Size by Application
2.5.1 Molecular Modelling Software Market Size CAGR by Application (2019 VS 2023 VS 2030)
2.5.2 Global Molecular Modelling Software Market Size Market Share by Application (2019-2024)
3 Molecular Modelling Software Market Size by Player
3.1 Molecular Modelling Software Market Size Market Share by Player
3.1.1 Global Molecular Modelling Software Revenue by Player (2019-2024)
3.1.2 Global Molecular Modelling Software Revenue Market Share by Player (2019-2024)
3.2 Global Molecular Modelling Software Key Players Head office and Products Offered
3.3 Market Concentration Rate Analysis
3.3.1 Competition Landscape Analysis
3.3.2 Concentration Ratio (CR3, CR5 and CR10) & (2022-2024)
3.4 New Products and Potential Entrants
3.5 Mergers & Acquisitions, Expansion
4 Molecular Modelling Software by Region
4.1 Molecular Modelling Software Market Size by Region (2019-2024)
4.2 Global Molecular Modelling Software Annual Revenue by Country/Region (2019-2024)
4.3 Americas Molecular Modelling Software Market Size Growth (2019-2024)
4.4 APAC Molecular Modelling Software Market Size Growth (2019-2024)
4.5 Europe Molecular Modelling Software Market Size Growth (2019-2024)
4.6 Middle East & Africa Molecular Modelling Software Market Size Growth (2019-2024)
5 Americas
5.1 Americas Molecular Modelling Software Market Size by Country (2019-2024)
5.2 Americas Molecular Modelling Software Market Size by Type (2019-2024)
5.3 Americas Molecular Modelling Software Market Size by Application (2019-2024)
5.4 United States
5.5 Canada
5.6 Mexico
5.7 Brazil
6 APAC
6.1 APAC Molecular Modelling Software Market Size by Region (2019-2024)
6.2 APAC Molecular Modelling Software Market Size by Type (2019-2024)
6.3 APAC Molecular Modelling Software Market Size by Application (2019-2024)
6.4 China
6.5 Japan
6.6 South Korea
6.7 Southeast Asia
6.8 India
6.9 Australia
7 Europe
7.1 Europe Molecular Modelling Software Market Size by Country (2019-2024)
7.2 Europe Molecular Modelling Software Market Size by Type (2019-2024)
7.3 Europe Molecular Modelling Software Market Size by Application (2019-2024)
7.4 Germany
7.5 France
7.6 UK
7.7 Italy
7.8 Russia
8 Middle East & Africa
8.1 Middle East & Africa Molecular Modelling Software by Region (2019-2024)
8.2 Middle East & Africa Molecular Modelling Software Market Size by Type (2019-2024)
8.3 Middle East & Africa Molecular Modelling Software Market Size by Application (2019-2024)
8.4 Egypt
8.5 South Africa
8.6 Israel
8.7 Turkey
8.8 GCC Countries
9 Market Drivers, Challenges and Trends
9.1 Market Drivers & Growth Opportunities
9.2 Market Challenges & Risks
9.3 Industry Trends
10 Global Molecular Modelling Software Market Forecast
10.1 Global Molecular Modelling Software Forecast by Region (2025-2030)
10.1.1 Global Molecular Modelling Software Forecast by Region (2025-2030)
10.1.2 Americas Molecular Modelling Software Forecast
10.1.3 APAC Molecular Modelling Software Forecast
10.1.4 Europe Molecular Modelling Software Forecast
10.1.5 Middle East & Africa Molecular Modelling Software Forecast
10.2 Americas Molecular Modelling Software Forecast by Country (2025-2030)
10.2.1 United States Market Molecular Modelling Software Forecast
10.2.2 Canada Market Molecular Modelling Software Forecast
10.2.3 Mexico Market Molecular Modelling Software Forecast
10.2.4 Brazil Market Molecular Modelling Software Forecast
10.3 APAC Molecular Modelling Software Forecast by Region (2025-2030)
10.3.1 China Molecular Modelling Software Market Forecast
10.3.2 Japan Market Molecular Modelling Software Forecast
10.3.3 Korea Market Molecular Modelling Software Forecast
10.3.4 Southeast Asia Market Molecular Modelling Software Forecast
10.3.5 India Market Molecular Modelling Software Forecast
10.3.6 Australia Market Molecular Modelling Software Forecast
10.4 Europe Molecular Modelling Software Forecast by Country (2025-2030)
10.4.1 Germany Market Molecular Modelling Software Forecast
10.4.2 France Market Molecular Modelling Software Forecast
10.4.3 UK Market Molecular Modelling Software Forecast
10.4.4 Italy Market Molecular Modelling Software Forecast
10.4.5 Russia Market Molecular Modelling Software Forecast
10.5 Middle East & Africa Molecular Modelling Software Forecast by Region (2025-2030)
10.5.1 Egypt Market Molecular Modelling Software Forecast
10.5.2 South Africa Market Molecular Modelling Software Forecast
10.5.3 Israel Market Molecular Modelling Software Forecast
10.5.4 Turkey Market Molecular Modelling Software Forecast
10.6 Global Molecular Modelling Software Forecast by Type (2025-2030)
10.7 Global Molecular Modelling Software Forecast by Application (2025-2030)
10.7.1 GCC Countries Market Molecular Modelling Software Forecast
11 Key Players Analysis
11.1 ANSYS, Inc (U.S.)
11.1.1 ANSYS, Inc (U.S.) Company Information
11.1.2 ANSYS, Inc (U.S.) Molecular Modelling Software Product Offered
11.1.3 ANSYS, Inc (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.1.4 ANSYS, Inc (U.S.) Main Business Overview
11.1.5 ANSYS, Inc (U.S.) Latest Developments
11.2 Frontline Data Solutions (U.S.)
11.2.1 Frontline Data Solutions (U.S.) Company Information
11.2.2 Frontline Data Solutions (U.S.) Molecular Modelling Software Product Offered
11.2.3 Frontline Data Solutions (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.2.4 Frontline Data Solutions (U.S.) Main Business Overview
11.2.5 Frontline Data Solutions (U.S.) Latest Developments
11.3 FindMolecule (Canada)
11.3.1 FindMolecule (Canada) Company Information
11.3.2 FindMolecule (Canada) Molecular Modelling Software Product Offered
11.3.3 FindMolecule (Canada) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.3.4 FindMolecule (Canada) Main Business Overview
11.3.5 FindMolecule (Canada) Latest Developments
11.4 Metso (Finland)
11.4.1 Metso (Finland) Company Information
11.4.2 Metso (Finland) Molecular Modelling Software Product Offered
11.4.3 Metso (Finland) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.4.4 Metso (Finland) Main Business Overview
11.4.5 Metso (Finland) Latest Developments
11.5 eLogger (U.S.)
11.5.1 eLogger (U.S.) Company Information
11.5.2 eLogger (U.S.) Molecular Modelling Software Product Offered
11.5.3 eLogger (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.5.4 eLogger (U.S.) Main Business Overview
11.5.5 eLogger (U.S.) Latest Developments
11.6 Chemstations Inc. (U.S.)
11.6.1 Chemstations Inc. (U.S.) Company Information
11.6.2 Chemstations Inc. (U.S.) Molecular Modelling Software Product Offered
11.6.3 Chemstations Inc. (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.6.4 Chemstations Inc. (U.S.) Main Business Overview
11.6.5 Chemstations Inc. (U.S.) Latest Developments
11.7 deepmatter Group Limited (Germany)
11.7.1 deepmatter Group Limited (Germany) Company Information
11.7.2 deepmatter Group Limited (Germany) Molecular Modelling Software Product Offered
11.7.3 deepmatter Group Limited (Germany) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.7.4 deepmatter Group Limited (Germany) Main Business Overview
11.7.5 deepmatter Group Limited (Germany) Latest Developments
11.8 Antipodes Scientific Ltd. (New Zealand)
11.8.1 Antipodes Scientific Ltd. (New Zealand) Company Information
11.8.2 Antipodes Scientific Ltd. (New Zealand) Molecular Modelling Software Product Offered
11.8.3 Antipodes Scientific Ltd. (New Zealand) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.8.4 Antipodes Scientific Ltd. (New Zealand) Main Business Overview
11.8.5 Antipodes Scientific Ltd. (New Zealand) Latest Developments
11.9 Vicinity (U.S.)
11.9.1 Vicinity (U.S.) Company Information
11.9.2 Vicinity (U.S.) Molecular Modelling Software Product Offered
11.9.3 Vicinity (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.9.4 Vicinity (U.S.) Main Business Overview
11.9.5 Vicinity (U.S.) Latest Developments
11.10 Sivco Inc. (U.S.)
11.10.1 Sivco Inc. (U.S.) Company Information
11.10.2 Sivco Inc. (U.S.) Molecular Modelling Software Product Offered
11.10.3 Sivco Inc. (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.10.4 Sivco Inc. (U.S.) Main Business Overview
11.10.5 Sivco Inc. (U.S.) Latest Developments
11.11 Labcup, Ltd. (U.K.)
11.11.1 Labcup, Ltd. (U.K.) Company Information
11.11.2 Labcup, Ltd. (U.K.) Molecular Modelling Software Product Offered
11.11.3 Labcup, Ltd. (U.K.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.11.4 Labcup, Ltd. (U.K.) Main Business Overview
11.11.5 Labcup, Ltd. (U.K.) Latest Developments
11.12 QIAGEN (Germany)
11.12.1 QIAGEN (Germany) Company Information
11.12.2 QIAGEN (Germany) Molecular Modelling Software Product Offered
11.12.3 QIAGEN (Germany) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.12.4 QIAGEN (Germany) Main Business Overview
11.12.5 QIAGEN (Germany) Latest Developments
11.13 Alchemy Cloud, Inc. (U.S.)
11.13.1 Alchemy Cloud, Inc. (U.S.) Company Information
11.13.2 Alchemy Cloud, Inc. (U.S.) Molecular Modelling Software Product Offered
11.13.3 Alchemy Cloud, Inc. (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.13.4 Alchemy Cloud, Inc. (U.S.) Main Business Overview
11.13.5 Alchemy Cloud, Inc. (U.S.) Latest Developments
11.14 YASH Technologies (U.S.)
11.14.1 YASH Technologies (U.S.) Company Information
11.14.2 YASH Technologies (U.S.) Molecular Modelling Software Product Offered
11.14.3 YASH Technologies (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.14.4 YASH Technologies (U.S.) Main Business Overview
11.14.5 YASH Technologies (U.S.) Latest Developments
11.15 Yordas Limited (U.K.)
11.15.1 Yordas Limited (U.K.) Company Information
11.15.2 Yordas Limited (U.K.) Molecular Modelling Software Product Offered
11.15.3 Yordas Limited (U.K.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.15.4 Yordas Limited (U.K.) Main Business Overview
11.15.5 Yordas Limited (U.K.) Latest Developments
11.16 Kintech Lab (Russia)
11.16.1 Kintech Lab (Russia) Company Information
11.16.2 Kintech Lab (Russia) Molecular Modelling Software Product Offered
11.16.3 Kintech Lab (Russia) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.16.4 Kintech Lab (Russia) Main Business Overview
11.16.5 Kintech Lab (Russia) Latest Developments
11.17 Hypercube, Inc. (U.S.)
11.17.1 Hypercube, Inc. (U.S.) Company Information
11.17.2 Hypercube, Inc. (U.S.) Molecular Modelling Software Product Offered
11.17.3 Hypercube, Inc. (U.S.) Molecular Modelling Software Revenue, Gross Margin and Market Share (2019-2024)
11.17.4 Hypercube, Inc. (U.S.) Main Business Overview
11.17.5 Hypercube, Inc. (U.S.) Latest Developments
12 Research Findings and Conclusion
*If Applicable.