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XtalGazer: Using Predictive Computational
Tools to Transform Solid State Research into
a Precise Rational Science
At XtalGazer, we combine cutting-edge computational chemistry with comprehensive, automation-enhanced wet lab experimentation to deliver faster, deeper, and more reliable solid state insights. Our integrated approach ensures every stable form is identified, understood, and de-risked.
Unique Benefits of the XtalGazer Approach
Complete Risk Coverage
AI and Automation Powered Efficiency
Rapid Structure Elucidation
Proven Expertise
Flexible Partnership
Our Unique Benefits
Complete Risk Coverage
Up to 98% coverage of stable solid forms through an integrated empirical and computational de-risking approach. No surprises left undiscovered.
AI and Automation Powered Efficiency
Physics-based and machine-learning models predict the most probable experimental conditions, paired with proprietary automation to accelerate studies and maximize throughput.
Rapid Structure Elucidation
In-house single-crystal XRD and MicroED, supported by an expert crystallography team, enable fast structural determination and clear structure–property insight.
Proven Expertise
A seasoned solid-state team with over a decade of experience and more than 1,500 successful projects delivered.
Flexible Partnership
Service- and software-based partnerships with study designs tailored to your scientific objectives, timelines, and budget.
Our Unique Benefits
News & Updates
Explore All
2026-09-23
XtalGazer Debuts at ISIC 2026: Deep Integration of Quantum Computing, AI, and Experimentation Accelerates Solid-State Drug R&D
The XtalGazer team was invited to attend this year’s conference to share with global peers the latest progress of XtalPi in quantum computing and AI-driven solid-state R&D.
2026-08-26
XtalGazer to Attend ISIC 2026 in Budapest
XtalGazer will attend the 23rd International Symposium on Industrial Crystallization (ISIC 2026), taking place 6–9 September 2026 at the Danubius Hotel Helia in Budapest, Hungary.
2026-08-20
XtalGazer’s MicroED Technology Helps Crack the Structure of a New Class of Porous Materials
Led by Associate Researcher Gao Qiang and Researcher Wei Wei of the Shanghai Advanced Research Institute, Chinese Academy of Sciences, in collaboration with XtalPi’s Solid State Team and other partners,…
2026-07-03
XtalPi Solid State Team Invited to Author CSP Chapter in Comprehensive Medicinal Chemistry IV
XtalPi’s Solid-State Development team has been invited to author Chapter 2.24, “Prediction of Small Molecule Crystal Structures,” in the newly released Comprehensive Medicinal Chemistry, 4th Edition (Elsevier, 2026).
2026-06-17
XtalGazer Continues Sponsorship of the 2026 GRC Crystal Engineering Conference
XtalGazer is a proud continuing sponsor of the 2026 GRC Crystal Engineering Conference! 📅 Dates: June 21 – 26, 2026 📍 Venue: Newry, Maine, USA
2026-05-11
Meeting XtalGazer at the 41st APSTJ (Japan)
We are excited to announce that XtalPi Solid State Team will be attending the 41st Annual Meeting of the Academy of Pharmaceutical Science and Technology, Japan (APSTJ) from June 3–5,…
See every possibility. Mitigate every risk.
Move forward with confidence.
That is the power of XtalGazer
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