Company lists · Data refreshed November 2026

Top 25 Computational chemistry companies worldwide

RevenueBase identified 896 company matches for computational chemistry companies worldwide as of November 2026 and tracks 18,582 professional contacts across them, including 6,657 with verified work emails. The United States is the largest market and Hyderabad the largest hub.

This list covers company matches for computational chemistry companies worldwide, found by RevenueBase SmartSearch using the meaning of business descriptions in its company graph at Exact. Ranked by professionals tracked, largest first. Rows show recorded descriptions where available, Exact search membership and the snapshot date. Data refreshed November 6, 2026. Country and city lists for computational chemistry companies follow the table.

Published by RevenueBase, a B2B data infrastructure company. This list was built with RevenueBase SmartSearch, the natural-language company search RevenueBase customers use to build their own targeted lists and unlock verified emails and direct dials at the companies on them. How these lists are built and judged.

How to read this list RevenueBase SmartSearch · Exact Recorded Nov 6, 2026 How this list was built
896Companies
18,582Contacts tracked
6,657Verified emails
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The 25 largest computational chemistry companies worldwide

Ranked by team size
Top 25 of 896 company matches for computational chemistry companies worldwide, ordered by professional contacts tracked in RevenueBase, largest first. Recorded Nov 6, 2026. The RevenueBase SmartSearch column shows Exact match membership in this saved search. Click a contact count to view that company's people. Totals use company locations recorded by RevenueBase; the displayed preview is a smaller selection.
#CompanyRevenueBase SmartSearchHeadquartersEmployeesContacts
1Exact matchBangalore, IndiaHQ recorded Nov 6, 20261,001-5,0002,370 contacts →

Exact match

“Anthem Biosciences, a Bangalore-India based Contract Research Development Organization (CDMO) Anthem Bio offers a whole gamut of services dedicated to enabling and sustaining…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
2Exact matchRadnor, PA, United StatesHQ recorded Nov 6, 20261,001-5,0001,214 contacts →

Exact match

“Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
3Exact matchKolkata, IndiaHQ recorded Nov 6, 20261,001-5,0001,069 contacts →

Exact match

“TCG Lifesciences Pvt.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
4Exact matchNew York, NY, United StatesHQ recorded Nov 6, 2026501-1,000979 contacts →

Exact match

“Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
5Exact matchVerona, ItalyHQ recorded Nov 6, 2026501-1,000678 contacts →

Exact match

“Aptuit, an Evotec company, is a pharmaceutical services provider that offers the most complete set of integrated early discovery to mid-phase drug development solutions by…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
6Exact matchNoida, IndiaHQ recorded Nov 6, 2026501-1,000366 contacts →

Exact match

“Jubilant Chemsys Ltd (JCL); a company registered under the Indian Companies Act, 1956 offers services in synthetic, organic and medicinal chemistry areas to various pharmaceutical…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
7Exact matchNijmegen, NetherlandsHQ recorded Nov 6, 2026501-1,000363 contacts →

Exact match

“Symeres is a leading contract research, development and manufacturing organization (CDMO & CRO) supporting pharmaceutical and biotechnology companies across the full drug…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
8Exact matchHyderabad, IndiaHQ recorded Nov 6, 2026501-1,000317 contacts →

Exact match

“LAXAI Life Sciences is a leading small molecule CRDMO providing end-to-end Integrated Drug Discovery, Development, and Manufacturing solutions to the pharmaceutical and biotech…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
9Exact matchHyderabad, IndiaHQ recorded Nov 6, 2026201-500311 contacts →

Exact match

“Chemveda Life Sciences is a mid-sized, fast-growing solution provider to the pharmaceutical, biotechnology, academia, and agrochemical industries.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
10Exact matchMontreal, QC, CanadaHQ recorded Nov 6, 2026201-500259 contacts →

Exact match

Recorded description not available.

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
11Exact matchCambridge, MA, United StatesHQ recorded Nov 6, 2026501-1,000257 contacts →

Exact match

“We are a quantum physics-based, AI-powered drug R&D company with the mission to revolutionize drug discovery and development by improving the speed, scale, novelty and success…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
12Exact matchHyderabad, IndiaHQ recorded Nov 6, 2026501-1,000220 contacts →

Exact match

“At PI Health Sciences, we provide fully integrated drug discovery solutions, combining synthetic and medicinal chemistry, biology, and AI-driven technologies.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
13Exact matchDurham, NC, United StatesHQ recorded Nov 6, 2026201-500200 contacts →

Exact match

“Simulations Plus is a leading provider of modeling and simulation software and consulting services supporting drug discovery, development research, and regulatory submissions.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
14Exact matchToronto, ON, CanadaHQ recorded Nov 6, 2026201-500187 contacts →

Exact match

“Advanced Chemistry Development, Inc,(ACD/Labs) develops and commercialzes informatics solutions for chemical, biochemical, and pharmaceutical R&D.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
15Exact matchNew Castle, DE, United StatesHQ recorded Nov 6, 202651-200183 contacts →

Exact match

“Adesis Inc.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
16Exact matchGlasgow, United KingdomHQ recorded Nov 6, 202651-200181 contacts →

Exact match

“Accelerating molecular discovery through the power of Chemputation.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
17Exact matchBudapest, HungaryHQ recorded Nov 6, 2026201-500181 contacts →

Exact match

“Chemaxon is a leading cheminformatics company, setting the industry standard for quality and accuracy.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
18Exact matchNew York, NY, United StatesHQ recorded Nov 6, 202651-200173 contacts →

Exact match

“D.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
19Exact matchPlanegg-martinsried, GermanyHQ recorded Nov 6, 202651-200160 contacts →

Exact match

“Proteros is an early drug discovery partner for even the most technically challenging targets, from target through to lead progression.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
20Exact matchPasadena, CA, United StatesHQ recorded Nov 6, 202651-200144 contacts →

Exact match

“Terray is a biotechnology company with the technology, data, and mindset to radically change the way we discover and develop small molecule therapeutics.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
21Exact matchGilroy, United StatesHQ recorded Nov 6, 202651-200128 contacts →

Exact match

“At Aganitha, we make AI work for Science.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
22Exact matchUppsala, SwedenHQ recorded Nov 6, 202651-200124 contacts →

Exact match

“We offer consulting services focused on the application of quantitative approaches to support drug research, development, and life-cycle decisions.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
23Exact matchToronto, CanadaHQ recorded Nov 6, 202651-200113 contacts →

Exact match

“Deep Genomics collaborates across disciplines to solve hard molecular design and target biology problems historically requiring slow, empirical iteration.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
24Exact matchSanta Fe, United StatesHQ recorded Nov 6, 202651-200112 contacts →

Exact match

“OpenEye, Cadence Molecular Sciences is an industry leader in computational molecular design based on decades of delivering rapid, robust, and scalable software, toolkits, and…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
25Exact matchShanghai, ChinaHQ recorded Nov 6, 20261,001-5,000111 contacts →

Exact match

“Established in 2008, Viva Biotech (01873.HK) provides one-stop services ranging from early-stage Structure-Based Drug R&D to commercial manufacturing to global biopharmaceutical…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase

Showing 25 of 896 computational chemistry companies worldwide

See the full list, filter by size, metro and specialty, and access 6,657 tracked professional contacts with verified work emails. Direct dials are available where recorded.

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Computational chemistry companies worldwide at a glance

As of Nov 6, 2026
35.8%Verified-email coverage
20.7Average contacts per company
1-10Median size (employees)
3.8%Largest-city concentration · Hyderabad
Nov 6, 2026Page data refreshed

Companies by employee count

1-10
525
11-50
249
51-200
84
201-500
15
501-1,000
11
1,001-5,000
7
5,001-10,000
1

Email recency is reported on each country list linked below.

How this list was built

The recorded descriptions help you assess these company matches. Check a company’s website for its current services and locations.

Source
The RevenueBase company graph: 60 million companies and 398.9 million professional contacts resolved from primary sources, queried with RevenueBase SmartSearch, the natural-language company search available to every RevenueBase user.
Coverage
Every country. Country and city lists for computational chemistry companies are linked below.
What qualifies
Company records worldwide whose business descriptions match “computational chemistry companies” by meaning at the Exact setting. Descriptions are compiled in the RevenueBase company graph from public websites, profiles and company information where available; they are not guaranteed quotations from the company's website.
RevenueBase SmartSearch
Describe a niche company in your own words to find businesses by meaning. Exact, Similar, Related and Broad control the breadth of RevenueBase SmartSearch. This saved list uses Exact. Each row's Exact match badge shows inclusion in that search, not an individual score or a service-quality judgment.
Public preview
The public preview omits records without a verified work email. Dataset totals and geographic summaries describe the full matched records before these preview filters.
Match quality
RevenueBase's August 25, 2026 study assessed 4,198 description/company pairs across matching settings. The publisher reports 86% good or better at Exact. This evaluates the method across queries; it does not audit this individual list. Recorded company descriptions, where available, help you judge each match yourself. Read the full methodology: how the lists are built and what the study measures.
Ranking
Team size, largest first: companies are ordered by the number of professionals RevenueBase tracks at each one. Employee ranges shown are reported bands, for context.
Verification
Every displayed company carries at least one verified work email. RevenueBase tracks 6,657 professional contacts with verified work emails across the full matched dataset. Contacts re-verify on a rolling cadence, and each contact's own verification date is shown inside RevenueBase.
Refresh
This page's figures were pulled from the company graph on November 6, 2026. Lists refresh periodically as the graph is re-checked.
Record context
Company records and descriptions can change. Check the company's website for its current services and locations.

Computational chemistry companies by location

6 lists · largest first

Every Computational chemistry companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.

Countries

Cities

Frequently asked

What is RevenueBase SmartSearch?

RevenueBase SmartSearch finds niche companies by the meaning of their business descriptions in the RevenueBase company graph. Exact, Similar, Related and Broad control how closely companies must fit your description. This list uses Exact for “computational chemistry companies”; each Exact match badge shows search membership, not an individual similarity or quality score.

How many computational chemistry companies are there worldwide?

RevenueBase identified 896 company matches for computational chemistry companies worldwide as of November 2026, using the meaning of business descriptions at Exact. This is the recorded matched set in the RevenueBase company graph.

What is the largest company on this list?

Anthem Biosciences Limited tops the displayed preview by professional contacts tracked in RevenueBase. Recorded headquarters appear in the company rows.

Which country has the most computational chemistry companies?

The United States leads with 236 companies, followed by India (97) and the United Kingdom (55). Every computational chemistry companies list by country and city is linked on this page.

Which city has the most computational chemistry companies?

Hyderabad leads with 34 company records, followed by Cambridge (17) and Bangalore (11).

How do I get contact information for these companies?

A free RevenueBase account lets you run this exact search and work limited free results with 500 credits to start. Upgrading provides access to the 6,657 professional contacts with verified work emails tracked across these 896 companies; direct dials are available where recorded.

How current is this list?

The list refreshes periodically as the company graph is re-checked. This page's figures were pulled on November 6, 2026.

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About this data

RevenueBase is a B2B data infrastructure company. Its company graph covers 60 million companies and 398.9 million professional contacts, with emails verified on a rolling cadence rather than scraped once and left to decay. These company lists are generated directly from that graph with RevenueBase SmartSearch, the same natural-language company search every RevenueBase user has: describe a market in plain words, get the companies that match, and add verified emails and direct dials for the people at them. It is the same data that powers RevenueBase's B2B data products, and a free account includes 500 credits to start. How these lists are built and judged.