🚀 Now Live in Qatar — Formulation Sprints · Vendor-Managed Inventory · Invested in by QDB Request your free sprint →
Quantified Material Intelligence

From Formula to Factory Floor

Two halves of one problem, on one platform. 10-day AI-validated formulation sprints that end 18-month R&D cycles — and vendor-managed inventory that keeps the materials behind them flowing. Built in Doha. QCS mapped.

QDB ✦ Invested in by Qatar Development Bank
Trust Engine v3 — Active Sprint ✓ VALIDATED
High-Performance Concrete — Qatar Climate
Physics-validated formulation · QCS mapped
Physics Validation100%
QCS Mapping Check100%
Thermal Stability (55°C)97%
10
Days to Result
0
Failed Tests
>90%
Accuracy
10×
Faster R&D Cycles
70%
Cost Reduction
100%
Lab-Validation Rate
$0
Spent on Failed Tests

In the sprint shown, every candidate delivered passed physics validation before reaching a lab, and no failed test was carried forward. Figures describe MoleQuant engagements and vary by challenge — they are not a general guarantee.

About MoleQuant

Built for Qatar & GCC.
Engineered for excellence.

The only materials platform purpose-built for the GCC — not adapted, not translated. We run both halves of the industrial materials problem: discovering the formulation, and supplying the raw materials it depends on. Built from the ground up for the region's industrial environment: QCS standards, Arabic workflows, and local data sovereignty.

🧬

Quantified Material Intelligence

Deep computational materials science fused with AI architecture to deliver validated formulations that standard R&D cannot reliably produce. Our team brings 30+ years of combined experience across materials science, AI systems, and GCC enterprise.

🏛️

Invested in by QDB

When Qatar's sovereign development institution backs you, it signals one thing: the government trusts the science. QDB doesn't invest in ordinary — and neither do we.

📈

$2.1M Client Savings

R&D cost savings created for paying clients across Saudi Arabia and Oman — now live in Qatar. Cross-border demand validated, with zero failed tests across all delivered sprints.

72% gross margin · 100% pass rate
🛡️

QCS Mapping

Every formulation is mapped against Qatar Construction Specifications before a single experiment is run.

🔒

Local Data Sovereignty

Your R&D data stays in Qatar. Local hosting meets the strictest enterprise security and government sovereignty requirements.

🌐

Full Arabic Interface

A complete R&D workflow in Arabic and English — RTL throughout. Live and operational today.

🔐

Isolated by Design

On the VMI side we hold stock for customers who compete with each other. Every query is restricted to your organisation in the database itself — your stock levels, pricing, suppliers and contracts are invisible to everyone else on the platform.

📜

Audit-Ready by Default

Every change carries what it was before and after, in a record nobody can edit afterwards. Seven roles with genuine separation of duties — a storekeeper adjusts stock but cannot approve a purchase order.

Evidence for a service review, not a preference
🗓️

Runs on the Gulf Calendar

Friday and Saturday are the weekend, Ramadan hours and public holidays are respected, Hijri dates sit alongside Gregorian. Every “three working days” lands on the right day.

Core Service 01 — Chemical Formula

A validated formulation
in ten days.

You bring a chemical formula and the problem it has to solve. You get back a formulation that has already survived physics validation, with the synthesis route, compliance mapping and safety documentation to produce it — in ten days rather than eighteen months.

🔬

Nothing reaches you unchecked

Candidate formulations are proposed by a language model, then screened against retrieved records from Materials Project, PubChem, NIST and OQMD. Every numeric claim is corroborated against independently computed predictions and flagged where it cannot be — and carbon figures, patent numbers and property values are barred by design from originating in a model at all.

📐

Validated before the lab

Every candidate passes QSPR property prediction and a physics check before it reaches you. The expensive part of R&D is failed experiments; this is how they stop happening.

100% pass rate · zero failed tests
📋

The whole dossier, not a suggestion

Synthesis route, cost analysis, QCS mapping, carbon footprint and safety documentation — in English and Arabic. Enough to take into production, not just into a meeting.

🧭

Expert-gated, never automatic

No formulation is released by a machine. Our team reviews every candidate set before it is delivered, which is why the pass rate holds.

Go deeper: the validation engine · how a sprint runs · what you receive

ROI Calculator

See what failed experiments are costing you

5
14
70%
$100,000
Estimated annual savings
$350,000
in avoided failed-experiment cost, per year
3–4
Failed experiments avoided / year
5.7 yrs
R&D time recovered / year
Estimates from your inputs. Counts direct failed-experiment cost only — deliberately conservative. Not a quotation.
One Platform

Two halves of the same problem

Discovering the right material and actually having it on site are not separate concerns — they are the same industrial problem, split in two by the software that usually serves them. MoleQuant runs both ends, so a validated formulation does not stop at a document.

01

Formulate

A ten-day sprint turns a challenge into a physics-validated formulation.

02

Validate

The output names exactly which raw materials, in what quantities, to what specification.

03

Supply

The same team sources, plans and replenishes those materials so production can actually run.

One engagement, one team, one accountable party — from the formula to the factory floor.

Core Service 02 — Vendor-Managed Inventory

Vendor-Managed
Inventory

MoleQuant's VMI service extends beyond formulation into your ongoing materials supply chain — giving you continuous visibility and control over the raw materials your formulations depend on, backed by our team's 18 years of GCC industrial procurement experience.

What VMI gives you

📊

Visibility across your sites

Current stock positions for every site you operate, in one place, in Arabic or English — with alerts that fire before a shortage becomes a stoppage. We run the system; you see through it.

Your data isolated from every other customer
🔄

Proactive replenishment planning

Replenishment planned ahead of demand rather than in reaction to it, reducing both stockouts that halt production and the overstock that quietly ties up working capital.

🤝

Coordinated supplier management

One counterparty managing the suppliers behind your raw materials, streamlining procurement workflows instead of adding another interface to them.

🔗

Continuous with your sprint

When a Chemical Formula sprint finishes, the validated formulation hands straight over to the team that sources it — same people, same engagement. The materials list does not have to be re-specified or re-tendered.

What is included

Every item below is live today.

Control & governance
🔐 Your data isolated from other customers
👥 Seven roles, separated duties
✅ Approval routing & spend limits
📜 Activity record that cannot be edited
🛡️ Impossible quantities refused outright
Stock & materials
🔖 Batch, certificate & expiry, oldest issued first
🧮 Buy by drum, hold in kg, issue in litres
📦 Goods receipt against what actually arrived
🏗️ Issued to a job, work order or cost centre
🤝 One pile of stock shared across contracts
☣️ Hazard register & safety sheet in two taps
Procurement
🔢 Order numbers people can quote
📄 Branded purchase orders, sent bilingual
⚖️ Several suppliers priced side by side
💱 Multi-currency, VAT & customs duty
📈 Where orders actually get stuck
Alerts & automation
🔔 Shortage alerts that settle, not stream
🔄 Re-checked the moment stock arrives
⏰ Contract expiry & expiring-stock warnings
📊 Scheduled summaries that arrive on their own
🎯 Minimum levels that recalculate themselves
Built for the Gulf
🌐 Full Arabic interface, right to left
🗓️ Fri–Sat week, Hijri dates, Ramadan hours
📥 Live in a day from your own spreadsheet
Why it matters

For industrial manufacturers, materials discovery and materials supply are two halves of the same problem. MoleQuant is one of the only platforms in the GCC connecting physics-validated formulation directly to the procurement and inventory workflows that bring it to production.

ROI Calculator — VMI

See what your materials are costing you to hold

$12,000,000
60 days
4%
80 hrs
$15,000
Estimated annual benefit
$0
across write-off, downtime and competitive sourcing
$0
Working capital released (one-off)
$0
Expired stock not written off
$0
Downtime avoided / year
$0
Sourcing saving / year
Assumes 25% less stock held, 60% of write-off avoided by batch and expiry tracking, half of stockout downtime removed by alerting, and 3% off spend from competitive quoting. Working capital released is one-off and is excluded from the annual figure. Not a quotation.
The Science

Not a black box.
A physics-validated engine.

Generic AI guesses. MoleQuant reasons from real materials science — screening every candidate against a licensed, commercially-usable materials database and cross-checking each prediction against the laws of physics.

150K+crystal structures screened

Grounded in a computed materials database

We screen candidate materials against the Materials Project — an open database of more than 150,000 inorganic compounds with computed formation energies, convex-hull distances, band gaps and full crystal structures. Each candidate is checked for whether it is already known, how close to thermodynamically stable it is, and what the nearest documented composition looks like.

Data from the Materials Project (materialsproject.org), A. Jain et al., APL Materials 1, 011002 (2013), used under CC BY 4.0. MoleQuant is not affiliated with or endorsed by the Materials Project.
🗄️

Trusted Scientific Data

Integrates data from established open databases — Materials Project, PubChem, NIST, NOMAD, OQMD and ChemSpider — so predictions stand on the sources researchers already trust.

📐

QSPR Property Prediction

Quantitative structure–property models predict band gap, density, stability score and formation energy before anything reaches a lab.

✨

Generative Discovery

Our generative model proposes entirely novel candidate formulations — exploring chemistry beyond what's already been tried.

🎯

Bayesian Optimization

Multi-objective optimization tunes formulations across competing targets — performance, cost and compliance — at once.

⚛️

Trust Engine v3

Every AI-generated candidate is cross-validated against physical laws and manufacturing constraints. No black-box predictions — ever.

🔁

Self-Improving by Design

The platform is built to learn: lab feedback feeds an auto-learning knowledge base and retrains the models, so the engine sharpens with every sprint.

How It Works

From challenge to validated formulation
— and on to the shelf

Four steps discover the material. Four more keep it flowing. One loop, one team — and the last step feeds the first.

Step 01 / 08
Define the Challenge Your challenge enters the platform
  1. 01

    Define the Challenge

    Submit your materials challenge through the client portal — target properties, operating conditions and compliance requirements.

    Arabic interface
    QCS parameters pre-loaded
    15-minute setup
  2. 02

    AI Generates Candidates

    Our ML models analyse material properties and generate 50+ optimised candidates, ranked and scored entirely within our secure platform — delivering the top 2–3 validated options.

    50+ generated
    Top 2–3 delivered
    Secure in-platform scoring
  3. 03

    Physics Validation

    Every candidate is filtered through the Trust Engine — physical laws, manufacturing constraints and QCS mapping checks.

    100% physics-validated
    Zero black-box predictions
    QCS mapped
  4. 04

    Validated Result

    You receive a complete formulation package — synthesis pathway, cost analysis, compliance and safety documentation — in 10 days.

    Full document suite
    Arabic + English
    Lab-ready output
  5. 05

    Materials Specified

    The validated formulation names exactly which raw materials, in what quantity and to what specification. That list becomes the contract terms and the stock records — entered once, not retyped.

    Units converted automatically
    Hazard class carried across
    Minimum levels set from the contract
  6. 06

    Sourced & Approved

    One request goes to several suppliers and the replies are compared side by side on price, lead time and past performance. Orders route to the right approver by value, site or category before anything is committed.

    Quotes compared, losers retained
    Spend limits enforced server-side
    Numbered, branded, bilingual POs
  7. 07

    Received & Held

    Goods are received against what actually turned up — accepted, rejected and why — with the delivery note attached. Every quantity carries its batch, certificate and expiry, and leaves stock against a named job.

    Oldest stock issued first
    Safety sheet two taps away
    Issued to a job or cost centre
  8. 08

    Replenished

    What each site really consumes, how variable it is and how long the supplier truly takes set the minimum levels — recalculated and proposed with the reasoning shown, never changed silently. That consumption record is also what the next formulation is designed against.

    Alerts before a stoppage
    Less capital tied up in over-holding
    Feeds step 01 again
The Deliverables

One engagement. The whole paper trail.

A sprint returns not just a formulation but its full scientific, compliance, safety and sustainability documentation. VMI keeps producing documents long after it — the orders, receipts, registers and records that prove what was bought, held and consumed. All of it in Arabic and English.

Formulation & Science
🧪 MSDS
📋 Recipe
🧭 Synthesis Plan
📊 Enhanced Report
🖥️ Simulation
Compliance & Safety
🏛️ QCHCS Compliance
⚠️ MMAA Hazardous Materials
🏷️ ISO / ASTM / BS Tagging
🌍 Per-GCC-Country Compliance
Sustainability
♻️ Carbon Footprint
Procurement & supply — VMI
📄 Purchase Order (branded, bilingual)
📦 Goods Receipt & Inspection
⚖️ Quote Comparison
📝 Contract & Claims Record
📈 Procurement Stage Report
Inventory & custody — VMI
🔖 Batch & Expiry Register
☣️ Per-Site Hazardous Materials Register
🏗️ Consumption by Job or Cost Centre
🗂️ Activity Record (tamper-evident)
🎯 Stock Level Proposal, with reasoning

Documents are decision-support and pre-validation outputs to accelerate your own approval process.

Industries

Built for the GCC's hardest materials problems

From oil fields to mega-project construction sites, MoleQuant delivers validated formulations for the region's most demanding industrial sectors.

Oil & Gas
Construction Chemicals
Petrochemicals
Downstream Gas & LPG
Coatings & Paints
Polymers & Plastics
Ceramics
Water Treatment
Lubricants & Additives
Market Opportunity

A high-value, untapped market

A manufacturing-led economy with high R&D spend and zero AI materials-discovery competitors.

$20B+
Manufacturing GDP in Qatar
$5.5M
Serviceable Market (Year 1)
18.8%
Market CAGR
800+
Active Factories in Qatar
🏭

Diversification is accelerating

Qatar's industrial sector is expanding rapidly across Oil & Gas, Petrochemicals and Construction — all requiring advanced materials R&D.

🎯

Zero direct GCC competitors

No competitor occupies the fast-and-physics-validated quadrant. 10 days versus 12–18 months for legacy R&D platforms.

💎

High willingness to pay

A single avoided failed experiment ($100K+) justifies an entire annual subscription.

Build on MoleQuant

Beyond the two core services, MoleQuant is a platform. Connect validated materials intelligence directly into your own systems and scale it across your R&D organisation.

  • Secure API gateway with managed keys
  • Custom ERP / LIMS integrations
  • Subscription packages with usage quotas
  • Batch processing for high-volume screening
Engagement Model

Start free. Scale as you grow.

From a single proof-of-concept sprint to full enterprise deployment — a clear path at every stage.

Free Sprint

Prove the value with zero commitment.
Free / 10 days
  • 1 formulation challenge
  • AI candidate generation (50+)
  • Physics validation layer
  • QCS mapping check
  • Full formulation report (PDF)
  • Arabic + English output
Request Free Sprint →
Most Popular

Standard

Ongoing access for active R&D teams.
Contact Us / month
  • Unlimited challenges
  • Full Trust Engine v3 access
  • Complete document suite
  • Batch processing
  • Client portal (Arabic interface)
  • Priority support (24h)
  • QCS mapping
Get Started →

Enterprise

Dedicated infrastructure & integrations.
Custom / year
  • Dedicated instance in Qatar
  • Custom API / ERP / LIMS integration
  • White-label option
  • SLA with uptime guarantee
  • On-site training & onboarding
  • Dedicated account manager
  • Custom compliance frameworks
Talk to Sales →
Case Studies

Real problems. Real results.

Validated formulations for the region’s most demanding environments — and the supply chains that keep them running.

Vendor-Managed Inventory — Petrochemicals

Four sites, one stock position

A GCC petrochemical manufacturer was running four plants from four separate spreadsheets. Nobody could answer what was on hand across the group without a day of phone calls, drums of speciality additive were being written off past their expiry while an identical drum sat unused at another site, and every purchase order was retyped into the supplier’s portal by hand.

MoleQuant took the inventory under management. Opening stock came in from their own spreadsheets in a day rather than weeks of typing. Every quantity now carries its batch, certificate and expiry, with the oldest issued first and material flagged before it expires. Minimum levels are no longer numbers somebody typed once — they recalculate from what each site actually consumes and how long each supplier truly takes, and are proposed for approval rather than changed silently. Purchase orders leave the building as numbered, branded, bilingual PDFs, and every one of them routes through the customer’s own approval chain first.

Where the two halves met: when a Chemical Formula sprint revalidated one of their high-temperature formulations, the materials it specified fed straight into the same contracts and stock records — no re-specification, no re-tender, no second supplier hunt.

—
Expired stock written off
—
Working capital released
—
Stockout hours avoided
—
Sites on one stock position
Oil & Gas

High-Temperature Ceramic Proppants

A Saudi oil & gas client needed proppants able to withstand extreme downhole temperatures and pressures. MoleQuant delivered a validated formulation in 10 days — replacing a 14-month R&D cycle.

10 Days
vs 14 months
0
Failed tests
$420K
Value created
100%
Lab-validated
Construction — Qatar

Extreme-Climate Concrete

Qatar's high-salinity coastal environment and 55°C+ summer heat demand concrete that standard R&D cannot reliably produce. The Trust Engine delivered QCS-mapped, climate-validated formulations.

QCS
Fully compliant
55°C+
Validated
10 Days
Sprint time
0
Failed tests
Questions

The things people ask first

Answers to what comes up in almost every first conversation.

What exactly do I get at the end of a sprint?
A complete formulation package, not just a suggested composition: the synthesis pathway, cost analysis, compliance mapping and safety documentation — in English and Arabic. Every candidate has already passed physics validation before it reaches you.
How can it be ten days when our current cycle is eighteen months?
Because the expensive part of conventional R&D is failed laboratory work. Candidates are screened computationally against materials databases and physical constraints first, so what reaches your bench is the two or three that survived rather than the fifty that did not. You are not running experiments faster — you are running far fewer of them.
Is my formulation data confidential?
Yes. Work submitted by one client is scoped to that client and is not visible to any other. General materials-science knowledge is shared across the platform; your own formulations, results and documents are not. Anything derived from your work stays private unless it is explicitly generalised and released, which is a reviewed decision rather than an automatic one.
What do you screen candidates against?
The Materials Project — an open database of more than 150,000 inorganic compounds with computed formation energies, convex-hull distances, band gaps and crystal structures. A candidate is checked for whether it is already documented, how far it sits above the convex hull, and what the nearest known composition is.

We are sometimes asked about GNoME, Google DeepMind's larger dataset of roughly 2.2 million structures published in Nature in 2023. We do not use it, and the reason is a licence rather than a technical one: GNoME's data is released under CC BY-NC 4.0, which does not permit commercial use. MoleQuant has paying clients, so putting that data into a client deliverable is not something the licence allows. The Materials Project is CC BY 4.0, which does — and it publishes the crystal structures our diffraction work needs. We would rather screen against a smaller database we are entitled to use than a larger one we are not.

Data from the Materials Project, used under CC BY 4.0. MoleQuant is not affiliated with or endorsed by the Materials Project or by Google DeepMind.
Is the AI just guessing?
No — and this is the part worth being precise about. Every AI-generated candidate is cross-checked against physical laws and manufacturing constraints before it is shown to you. Predictions that cannot be grounded are rejected rather than reported. Where a figure is indicative rather than measured, the output says so.
Do you work outside Qatar?
Yes. The platform carries climate and compliance profiles for Saudi Arabia, the UAE, Qatar, Kuwait, Bahrain, Oman, Jordan and Egypt — each with its own thermal, chemical and mechanical targets rather than one generic regional setting. QCS mapping is specific to Qatari projects.
Get In Touch

Ready to transform your R&D?

Tell us about your materials challenge. We'll show you exactly how MoleQuant compresses your R&D cycle and eliminates failed experiments. We respond within 24 hours — no commitment for the free sprint.

We respond within 24 hours · No commitment required for the free sprint

📍
Office
Level 18, Tornado Tower, West Bay, Doha — Qatar

✦ Invested in by Qatar Development Bank

Qatar's sovereign development institution doesn't back ordinary ventures. QDB's investment signals that the highest levels of Qatar's government trust the science — and the team behind it.

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