Summary

The global market for Molecular Dynamics Software was estimated to be worth US$ 106 million in 2024 and is forecast to a readjusted size of US$ 143 million by 2031 with a CAGR of 4.1% during the forecast period 2025-2031.
Molecular dynamics (MD) is a computer simulation method for analysing the physical movements of atoms and molecules. The atoms and molecules are allowed to interact for a fixed period of time, giving a view of the dynamic "evolution" of the system. In the most common version, the trajectories of atoms and molecules are determined by numerically solving Newton's equations of motion for a system of interacting particles, where forces between the particles and their potential energies are often calculated using interatomic potentials or molecular mechanics force fields. The method is applied mostly in chemical physics, materials science, and biophysics.
Global Molecular Dynamics Software key players include D.E. Shaw Research, YASARA Biosciences, MBN Research Center, Culgi BV, Intel, etc. Global top five players hold a share about 70 %. Aisa-Pacific is the largest market, with a share about 50%, followed by North America and Europe, having a total share about 45 percent. In terms of product, GPU-accelerated is the largest segment, with a share about 70%. And in terms of application, the largest application is Materials Science Research, followed by Chemical Physics Research and Biophysics Research.
This report aims to provide a comprehensive presentation of the global market for Molecular Dynamics Software, focusing on the total sales revenue, key companies market share and ranking, together with an analysis of Molecular Dynamics Software by region & country, by Type, and by Application.
The Molecular Dynamics Software market size, estimations, and forecasts are provided in terms of sales revenue ($ millions), considering 2024 as the base year, with history and forecast data for the period from 2020 to 2031. With both quantitative and qualitative analysis, to help readers develop business/growth strategies, assess the market competitive situation, analyze their position in the current marketplace, and make informed business decisions regarding Molecular Dynamics Software.
Market Segmentation
By Company
Abalone
Software for Chemistry & Materials (SCM)
Ascalaph Designer
Avizo (Software)
CHARMM
CP2K
D.E. Shaw Research
GROMACS
GROMOS
LAMMPS
Schrödinger
MBN Explorer
MDynaMix
Molecular Modelling Toolkit
Nanoscale Molecular Dynamics
OpenAtom
Dassault Systemes
OpenEye
SHARC Molecular Dynamics Software
Tinker-HP
Fraunhofer SCAI
VOTCA
Winmostar
YASARA
Siemens (Culgi)
Intel
Segment by Type
GPU-accelerated
Working Only On CPU
Segment by Application
Chemical Physics Research
Materials Science Research
Biophysics Research
By Region
North America
United States
Canada
Asia-Pacific
China
Japan
South Korea
Southeast Asia
India
Australia
Rest of Asia-Pacific
Europe
Germany
France
U.K.
Italy
Netherlands
Nordic Countries
Rest of Europe
Latin America
Mexico
Brazil
Rest of Latin America
Middle East & Africa
Turkey
Saudi Arabia
UAE
Rest of MEA
Chapter Outline
Chapter 1: Introduces the report scope of the report, global total market size. This chapter also provides the market dynamics, latest developments of the market, the driving factors and restrictive factors of the market, the challenges and risks faced by manufacturers in the industry, and the analysis of relevant policies in the industry.
Chapter 2: Detailed analysis of Molecular Dynamics Software company competitive landscape, revenue market share, latest development plan, merger, and acquisition information, etc.
Chapter 3: Provides the analysis of various market segments by Type, covering the market size and development potential of each market segment, to help readers find the blue ocean market in different market segments.
Chapter 4: Provides the analysis of various market segments by Application, covering the market size and development potential of each market segment, to help readers find the blue ocean market in different downstream markets.
Chapter 5: Revenue of Molecular Dynamics Software in regional level. It provides a quantitative analysis of the market size and development potential of each region and introduces the market development, future development prospects, market space, and market size of each country in the world.
Chapter 6: Revenue of Molecular Dynamics Software in country level. It provides sigmate data by Type, and by Application for each country/region.
Chapter 7: Provides profiles of key players, introducing the basic situation of the main companies in the market in detail, including product revenue, gross margin, product introduction, recent development, etc.
Chapter 8: Analysis of industrial chain, including the upstream and downstream of the industry.
Chapter 9: Conclusion.

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Table of Contents

1 Market Overview
1.1 Molecular Dynamics Software Product Introduction
1.2 Global Molecular Dynamics Software Market Size Forecast (2020-2031)
1.3 Molecular Dynamics Software Market Trends & Drivers
1.3.1 Molecular Dynamics Software Industry Trends
1.3.2 Molecular Dynamics Software Market Drivers & Opportunity
1.3.3 Molecular Dynamics Software Market Challenges
1.3.4 Molecular Dynamics Software Market Restraints
1.4 Assumptions and Limitations
1.5 Study Objectives
1.6 Years Considered
2 Competitive Analysis by Company
2.1 Global Molecular Dynamics Software Players Revenue Ranking (2024)
2.2 Global Molecular Dynamics Software Revenue by Company (2020-2025)
2.3 Key Companies Molecular Dynamics Software Manufacturing Base Distribution and Headquarters
2.4 Key Companies Molecular Dynamics Software Product Offered
2.5 Key Companies Time to Begin Mass Production of Molecular Dynamics Software
2.6 Molecular Dynamics Software Market Competitive Analysis
2.6.1 Molecular Dynamics Software Market Concentration Rate (2020-2025)
2.6.2 Global 5 and 10 Largest Companies by Molecular Dynamics Software Revenue in 2024
2.6.3 Global Top Companies by Company Type (Tier 1, Tier 2, and Tier 3) & (based on the Revenue in Molecular Dynamics Software as of 2024)
2.7 Mergers & Acquisitions, Expansion
3 Segmentation by Type
3.1 Introduction by Type
3.1.1 GPU-accelerated
3.1.2 Working Only On CPU
3.2 Global Molecular Dynamics Software Sales Value by Type
3.2.1 Global Molecular Dynamics Software Sales Value by Type (2020 VS 2024 VS 2031)
3.2.2 Global Molecular Dynamics Software Sales Value, by Type (2020-2031)
3.2.3 Global Molecular Dynamics Software Sales Value, by Type (%) (2020-2031)
4 Segmentation by Application
4.1 Introduction by Application
4.1.1 Chemical Physics Research
4.1.2 Materials Science Research
4.1.3 Biophysics Research
4.2 Global Molecular Dynamics Software Sales Value by Application
4.2.1 Global Molecular Dynamics Software Sales Value by Application (2020 VS 2024 VS 2031)
4.2.2 Global Molecular Dynamics Software Sales Value, by Application (2020-2031)
4.2.3 Global Molecular Dynamics Software Sales Value, by Application (%) (2020-2031)
5 Segmentation by Region
5.1 Global Molecular Dynamics Software Sales Value by Region
5.1.1 Global Molecular Dynamics Software Sales Value by Region: 2020 VS 2024 VS 2031
5.1.2 Global Molecular Dynamics Software Sales Value by Region (2020-2025)
5.1.3 Global Molecular Dynamics Software Sales Value by Region (2026-2031)
5.1.4 Global Molecular Dynamics Software Sales Value by Region (%), (2020-2031)
5.2 North America
5.2.1 North America Molecular Dynamics Software Sales Value, 2020-2031
5.2.2 North America Molecular Dynamics Software Sales Value by Country (%), 2024 VS 2031
5.3 Europe
5.3.1 Europe Molecular Dynamics Software Sales Value, 2020-2031
5.3.2 Europe Molecular Dynamics Software Sales Value by Country (%), 2024 VS 2031
5.4 Asia Pacific
5.4.1 Asia Pacific Molecular Dynamics Software Sales Value, 2020-2031
5.4.2 Asia Pacific Molecular Dynamics Software Sales Value by Region (%), 2024 VS 2031
5.5 South America
5.5.1 South America Molecular Dynamics Software Sales Value, 2020-2031
5.5.2 South America Molecular Dynamics Software Sales Value by Country (%), 2024 VS 2031
5.6 Middle East & Africa
5.6.1 Middle East & Africa Molecular Dynamics Software Sales Value, 2020-2031
5.6.2 Middle East & Africa Molecular Dynamics Software Sales Value by Country (%), 2024 VS 2031
6 Segmentation by Key Countries/Regions
6.1 Key Countries/Regions Molecular Dynamics Software Sales Value Growth Trends, 2020 VS 2024 VS 2031
6.2 Key Countries/Regions Molecular Dynamics Software Sales Value, 2020-2031
6.3 United States
6.3.1 United States Molecular Dynamics Software Sales Value, 2020-2031
6.3.2 United States Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.3.3 United States Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.4 Europe
6.4.1 Europe Molecular Dynamics Software Sales Value, 2020-2031
6.4.2 Europe Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.4.3 Europe Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.5 China
6.5.1 China Molecular Dynamics Software Sales Value, 2020-2031
6.5.2 China Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.5.3 China Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.6 Japan
6.6.1 Japan Molecular Dynamics Software Sales Value, 2020-2031
6.6.2 Japan Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.6.3 Japan Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.7 South Korea
6.7.1 South Korea Molecular Dynamics Software Sales Value, 2020-2031
6.7.2 South Korea Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.7.3 South Korea Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.8 Southeast Asia
6.8.1 Southeast Asia Molecular Dynamics Software Sales Value, 2020-2031
6.8.2 Southeast Asia Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.8.3 Southeast Asia Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
6.9 India
6.9.1 India Molecular Dynamics Software Sales Value, 2020-2031
6.9.2 India Molecular Dynamics Software Sales Value by Type (%), 2024 VS 2031
6.9.3 India Molecular Dynamics Software Sales Value by Application, 2024 VS 2031
7 Company Profiles
7.1 Abalone
7.1.1 Abalone Profile
7.1.2 Abalone Main Business
7.1.3 Abalone Molecular Dynamics Software Products, Services and Solutions
7.1.4 Abalone Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.1.5 Abalone Recent Developments
7.2 Software for Chemistry & Materials (SCM)
7.2.1 Software for Chemistry & Materials (SCM) Profile
7.2.2 Software for Chemistry & Materials (SCM) Main Business
7.2.3 Software for Chemistry & Materials (SCM) Molecular Dynamics Software Products, Services and Solutions
7.2.4 Software for Chemistry & Materials (SCM) Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.2.5 Software for Chemistry & Materials (SCM) Recent Developments
7.3 Ascalaph Designer
7.3.1 Ascalaph Designer Profile
7.3.2 Ascalaph Designer Main Business
7.3.3 Ascalaph Designer Molecular Dynamics Software Products, Services and Solutions
7.3.4 Ascalaph Designer Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.3.5 Ascalaph Designer Recent Developments
7.4 Avizo (Software)
7.4.1 Avizo (Software) Profile
7.4.2 Avizo (Software) Main Business
7.4.3 Avizo (Software) Molecular Dynamics Software Products, Services and Solutions
7.4.4 Avizo (Software) Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.4.5 Avizo (Software) Recent Developments
7.5 CHARMM
7.5.1 CHARMM Profile
7.5.2 CHARMM Main Business
7.5.3 CHARMM Molecular Dynamics Software Products, Services and Solutions
7.5.4 CHARMM Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.5.5 CHARMM Recent Developments
7.6 CP2K
7.6.1 CP2K Profile
7.6.2 CP2K Main Business
7.6.3 CP2K Molecular Dynamics Software Products, Services and Solutions
7.6.4 CP2K Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.6.5 CP2K Recent Developments
7.7 D.E. Shaw Research
7.7.1 D.E. Shaw Research Profile
7.7.2 D.E. Shaw Research Main Business
7.7.3 D.E. Shaw Research Molecular Dynamics Software Products, Services and Solutions
7.7.4 D.E. Shaw Research Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.7.5 D.E. Shaw Research Recent Developments
7.8 GROMACS
7.8.1 GROMACS Profile
7.8.2 GROMACS Main Business
7.8.3 GROMACS Molecular Dynamics Software Products, Services and Solutions
7.8.4 GROMACS Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.8.5 GROMACS Recent Developments
7.9 GROMOS
7.9.1 GROMOS Profile
7.9.2 GROMOS Main Business
7.9.3 GROMOS Molecular Dynamics Software Products, Services and Solutions
7.9.4 GROMOS Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.9.5 GROMOS Recent Developments
7.10 LAMMPS
7.10.1 LAMMPS Profile
7.10.2 LAMMPS Main Business
7.10.3 LAMMPS Molecular Dynamics Software Products, Services and Solutions
7.10.4 LAMMPS Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.10.5 LAMMPS Recent Developments
7.11 Schrödinger
7.11.1 Schrödinger Profile
7.11.2 Schrödinger Main Business
7.11.3 Schrödinger Molecular Dynamics Software Products, Services and Solutions
7.11.4 Schrödinger Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.11.5 Schrödinger Recent Developments
7.12 MBN Explorer
7.12.1 MBN Explorer Profile
7.12.2 MBN Explorer Main Business
7.12.3 MBN Explorer Molecular Dynamics Software Products, Services and Solutions
7.12.4 MBN Explorer Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.12.5 MBN Explorer Recent Developments
7.13 MDynaMix
7.13.1 MDynaMix Profile
7.13.2 MDynaMix Main Business
7.13.3 MDynaMix Molecular Dynamics Software Products, Services and Solutions
7.13.4 MDynaMix Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.13.5 MDynaMix Recent Developments
7.14 Molecular Modelling Toolkit
7.14.1 Molecular Modelling Toolkit Profile
7.14.2 Molecular Modelling Toolkit Main Business
7.14.3 Molecular Modelling Toolkit Molecular Dynamics Software Products, Services and Solutions
7.14.4 Molecular Modelling Toolkit Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.14.5 Molecular Modelling Toolkit Recent Developments
7.15 Nanoscale Molecular Dynamics
7.15.1 Nanoscale Molecular Dynamics Profile
7.15.2 Nanoscale Molecular Dynamics Main Business
7.15.3 Nanoscale Molecular Dynamics Molecular Dynamics Software Products, Services and Solutions
7.15.4 Nanoscale Molecular Dynamics Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.15.5 Nanoscale Molecular Dynamics Recent Developments
7.16 OpenAtom
7.16.1 OpenAtom Profile
7.16.2 OpenAtom Main Business
7.16.3 OpenAtom Molecular Dynamics Software Products, Services and Solutions
7.16.4 OpenAtom Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.16.5 OpenAtom Recent Developments
7.17 Dassault Systemes
7.17.1 Dassault Systemes Profile
7.17.2 Dassault Systemes Main Business
7.17.3 Dassault Systemes Molecular Dynamics Software Products, Services and Solutions
7.17.4 Dassault Systemes Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.17.5 Dassault Systemes Recent Developments
7.18 OpenEye
7.18.1 OpenEye Profile
7.18.2 OpenEye Main Business
7.18.3 OpenEye Molecular Dynamics Software Products, Services and Solutions
7.18.4 OpenEye Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.18.5 OpenEye Recent Developments
7.19 SHARC Molecular Dynamics Software
7.19.1 SHARC Molecular Dynamics Software Profile
7.19.2 SHARC Molecular Dynamics Software Main Business
7.19.3 SHARC Molecular Dynamics Software Molecular Dynamics Software Products, Services and Solutions
7.19.4 SHARC Molecular Dynamics Software Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.19.5 SHARC Molecular Dynamics Software Recent Developments
7.20 Tinker-HP
7.20.1 Tinker-HP Profile
7.20.2 Tinker-HP Main Business
7.20.3 Tinker-HP Molecular Dynamics Software Products, Services and Solutions
7.20.4 Tinker-HP Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.20.5 Tinker-HP Recent Developments
7.21 Fraunhofer SCAI
7.21.1 Fraunhofer SCAI Profile
7.21.2 Fraunhofer SCAI Main Business
7.21.3 Fraunhofer SCAI Molecular Dynamics Software Products, Services and Solutions
7.21.4 Fraunhofer SCAI Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.21.5 Fraunhofer SCAI Recent Developments
7.22 VOTCA
7.22.1 VOTCA Profile
7.22.2 VOTCA Main Business
7.22.3 VOTCA Molecular Dynamics Software Products, Services and Solutions
7.22.4 VOTCA Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.22.5 VOTCA Recent Developments
7.23 Winmostar
7.23.1 Winmostar Profile
7.23.2 Winmostar Main Business
7.23.3 Winmostar Molecular Dynamics Software Products, Services and Solutions
7.23.4 Winmostar Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.23.5 Winmostar Recent Developments
7.24 YASARA
7.24.1 YASARA Profile
7.24.2 YASARA Main Business
7.24.3 YASARA Molecular Dynamics Software Products, Services and Solutions
7.24.4 YASARA Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.24.5 YASARA Recent Developments
7.25 Siemens (Culgi)
7.25.1 Siemens (Culgi) Profile
7.25.2 Siemens (Culgi) Main Business
7.25.3 Siemens (Culgi) Molecular Dynamics Software Products, Services and Solutions
7.25.4 Siemens (Culgi) Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.25.5 Siemens (Culgi) Recent Developments
7.26 Intel
7.26.1 Intel Profile
7.26.2 Intel Main Business
7.26.3 Intel Molecular Dynamics Software Products, Services and Solutions
7.26.4 Intel Molecular Dynamics Software Revenue (US$ Million) & (2020-2025)
7.26.5 Intel Recent Developments
8 Industry Chain Analysis
8.1 Molecular Dynamics Software Industrial Chain
8.2 Molecular Dynamics Software Upstream Analysis
8.2.1 Key Raw Materials
8.2.2 Raw Materials Key Suppliers
8.2.3 Manufacturing Cost Structure
8.3 Midstream Analysis
8.4 Downstream Analysis (Customers Analysis)
8.5 Sales Model and Sales Channels
8.5.1 Molecular Dynamics Software Sales Model
8.5.2 Sales Channel
8.5.3 Molecular Dynamics Software Distributors
9 Research Findings and Conclusion
10 Appendix
10.1 Research Methodology
10.1.1 Methodology/Research Approach
10.1.1.1 Research Programs/Design
10.1.1.2 Market Size Estimation
10.1.1.3 Market Breakdown and Data Triangulation
10.1.2 Data Source
10.1.2.1 Secondary Sources
10.1.2.2 Primary Sources
10.2 Author Details
10.3 Disclaimer