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Molecular Dynamics Simulation Software Market Segmentation by Application (Chemical Research, Materials Science Research, Biophysics Research, Medical Research, and Others); by End-User (Pharmaceutical Labs, Research Institutes, Academic Users, and Others) – Global Demand Analysis & Opportunity Outlook 2030

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Extensive insights into the Growth of Molecular Dynamics Simulation Software Market Market amidst COVID-19

Before we witness the stabilization of economic growth in Europe and North America, Asia Pacific is estimated to bounce back progressively with countries such as China, India, South Korea and Japan witnessing more opportunities to recover from the losses sustained during COVID-19.

Being the biggest market in Eastern Europe, Russia is estimated to take the lowest hit, offering a sigh of relief to the businesses operating in the country. Whereas, GCC is estimated to observe low investments due to the sliding prices of crude oil.

We evaluate the strategies and commitment of the Giant Players in the market towards creating products and services that customers value and rely on.

In an attempt to control and eliminate the surge of coronavirus cases and meet the demand for required medical devices along with providing efficient medical services, there is a drastic shift of investments from authoritative bodies towards the healthcare sector. Where the aftermath of this pandemic may take years to be measured, Research Nester estimates notable expansion of e-health, gaming, and media and entertainment industries till the whole situation is contained and the plan of action for the recovery process is determined. There is an estimated probability of the growth in businesses going back a year if the condition is controlled in the next 2-3 months.                                                         Request Insights

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·    May, 2018: Fujitsu Laboratories Ltd. announced the development of molecular simulation technology for drug discovery. This technology can accurately estimate binding affinity, to offer rough estimate of the efficiency of candidate drugs.

·    November, 2020: Siemens AG announced the acquisition of Culgi, a computational chemistry software company, in order to expand its portfolio to multiscale simulations in the process industries.

Global Molecular Dynamics Simulation Software Market Highlights over 2022 – 2030

The global molecular dynamics simulation software market is estimated to grow at a significant CAGR over the forecast period, i.e., 2022 – 2030. The growth of the market can be attributed to the increasing demand for simulation software amongst researchers for drug development. Molecular dynamics refers to the study of the structure and dynamics of a molecule, generally to investigate the atom location in space, and studying the nucleus. Molecular dynamics simulation software works on pre-designed algorithms and machine-learning principles to study the atom. These software are primarily based on the classical Newtonian dynamic equations. The applications of molecular dynamics simulation software, such as, machine-assisted drug designing, drug discovery, and others, are estimated to boost the market growth. Moreover, the growing demand for novel drugs and treatment methods to treat diseases, such as, cancer, sickle-cell anemia, aplasia, and others, is further anticipated to boost the growth of the market. According to the data by the World Health Organization (WHO), cancer caused nearly 10 million deaths in 2020. Moreover, another report by the WHO stated that approximately 5% of the global population carries the trait genes for sickle-cell anemia, thalassemia, and other hemoglobin disorders.

Molecular Dynamics Simulation Software MarketMoreover, the growing funding for research activities globally, and rising government awareness on the importance of rug discover, especially post the COVID-19 pandemic, are projected to play crucial role in the market growth. According to the data by the World Bank, 2.204% of the global GDP was spent for R&D activities in 2018. 

The market is segmented by application into chemical research, materials science research, biophysics research, medical research, and others, out of which, the biophysics research segment is anticipated to hold the notable share in the global molecular dynamics simulation software market over the forecast period owing to the major role of biophysics in designing of new drugs and studying new molecules. CLICK TO DOWNLOAD SAMPLE REPORT

Major Macro-Economic Indicators Impacting the Market Growth

Research Expenditure

The never-ending growth in internet accessibility around the world along with numerous technological advancements comprising 5G, blockchain, cloud services, Internet of Things (IoT), and Artificial Intelligence (AI) among others have significantly boosted the economic growth in the last two decades. As of April 2021, there were more than 4.5 billion users that were actively using the internet globally. Moreover, the growth in ICT sector has significantly contributed towards GDP growth, labor productivity, and R&D spending among other transformations of economies in different nations of the globe. Furthermore, the production of goods and services in the ICT sector is also contributing to the economic growth and development. As per the statistics in the United Nations Conference on Trade and Development’s database, the ICT good exports (% of total good exports) globally grew from 10.816 in 2015 to 11.536 in 2019. In 2019, these exports in Hong Kong SAR, China amounted to 56.65%, 25.23% in East Asia & Pacific, 26.50% in China, 25.77% in Korea, Rep., 8.74% in the United States, and 35.01% in Vietnam. These are some of the important factors that are boosting the growth of the market.

Global Molecular Dynamics Simulation Software Market Regional Synopsis

On the basis of geographical analysis, the global molecular dynamics simulation software market is segmented into five major regions including North America, Europe, Asia Pacific, Latin America and Middle East & Africa region. The market in Asia Pacific region is estimated to witness noteworthy growth over the forecast period on the back of growing investment in research activities, along with rapid development of research institutes and laboratories in countries, such as, China, Japan, South Korea, and others. According to the data by National Center for Biotechnology Information, there are more than 200 research facilities and 50 biotechnology and related research centers and colleges in China.

The market in the North America region is anticipated to gain the largest market share throughout the forecast period owing to the high adoption of advanced technology, and growing private investment in molecular research. Moreover, adoption of genomics and biotechnologies is also foreseen to fuel the market growth. Furthermore, the high R&D expenditure in the United States, is also estimated to boost the market growth in the region.

Molecular Dynamics Simulation Software Market

The global molecular dynamics simulation software market is further classified on the basis of region as follows:

  • North America (U.S. & Canada) Market size, Y-O-Y growth & Opportunity Analysis
  • Latin America (Brazil, Mexico, Argentina, Rest of Latin America) Market size, Y-O-Y growth & Opportunity Analysis
  • Europe (U.K., Germany, France, Italy, Spain, Hungary, Belgium, Netherlands & Luxembourg, NORDIC, Poland, Turkey, Russia, Rest of Europe) Market size, Y-O-Y growth & Opportunity Analysis
  • Asia-Pacific (China, India, Japan, South Korea, Indonesia, Malaysia, Australia, New Zealand, Rest of Asia-Pacific) Market size, Y-O-Y growth & Opportunity Analysis
  • Middle East and Africa (Israel, GCC (Saudi Arabia, UAE, Bahrain, Kuwait, Qatar, Oman), North Africa, South Africa, Rest of Middle East and Africa) Market size, Y-O-Y growth & Opportunity Analysis

Market Segmentation

Our in-depth analysis of the global molecular dynamics simulation software market includes the following segments:

By Application

  • Chemical Research
  • Materials Science Research
  • Biophysics Research
  • Medical Research
  • Others

By End-User

  • Pharmaceutical Labs
  • Research Institutes
  • Academic Users
  • Others

Growth Drivers

  • Increasing Research and Drug Development Activities
  • High Accuracy of Software in Molecular Dynamics Simulation Process


  • High Cost of Molecular Research
  • Lack of Enough Number of Researchers

Top Featured Companies Dominating the Market

Nanoscale Molecular Dynamics (NAMD), MBN Explorer, Large-scale Atomic/Molecular Massively Parallel Simulator (LAMMPS), GROMACS, and Chemistry at Harvard Macromolecular Mechanics (CHARMM), are some of the majorly used molecular dynamics simulation software. Various software developers such as, Software for Chemistry & Materials B.V., Ascalaph Designer, Fujitsu Laboratories Ltd., Siemens AG, and Schrödinger, Inc., are currently investing in the molecular dynamics simulation software market. Meanwhile, numerous major pharmaceutical companies are anticipated to further enter the market in the upcoming years.  


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