Skip to content
About Us
Careers
News & Events
Brands
Ailux
Investor Relationship
中文
About Us
Careers
News & Events
Brands
Ailux
Investor Relationship
中文
Solutions
Our approach
Close Our approach
Open Our approach
Digital Chemistry
Combined power of Al automation for digital chemistry
Idea creation
Molecule generation
Candidates screening
Drug Discovery
From idea to life-changing breakthrough
Hit discovery
Hit optimization
DMTA cycle
Structural biology
Drug development
Technology
Close Technology
Open Technology
AI & Quantum Physics
Automation and Digitalization
Resources
Close Resources
Open Resources
Case studies
Publications
Webinars
Contact us
01
Biotech insights for the
future
Explore
Case studies
Publications
Webinars
News & events
02
Case Studies
Explore all
Small Molecule Drug Discovery
Solid State Research
Application Notes
Biotech
,
Case Studies
,
Small Molecule Drug Discovery
Hit Identification – SARM1 Structural Elucidation By Internal Cryo-EM Platform
Case Studies
,
Small Molecule Drug Discovery
Identifying Novel FGFR3 Inhibitors By XtalPi-Curated HTS Diversity Library
Biotech
,
Case Studies
,
Small Molecule Drug Discovery
Hit Identification – Novel Hits for GPX4
Biotech
,
Case Studies
,
Small Molecule Drug Discovery
Lead Identification – Discovering Selective Inhibitors Against an Unreported Binding Pocket of SMARCA2 via a Rational Drug Design Approach
Application Notes
,
Solid State Research
Elucidate the Crystal Structure of a Poorly Crystalline Compound in 2 Weeks with MicroED and Targeted CSP
Application Notes
,
Case Studies
,
Solid State Research
Crystal Structure Prediction (CSP) De-risks Polymorph Instability by Providing a Deep Insight Into All Stable Forms
Case Studies
,
Solid State Research
Enhanced Salt Screening With Rational Experimental Design Guided by Salt Formation Propensity Prediction Model
Case Studies
,
Software
,
XFEP
Development of small molecule selective inhibitors with XFEP
Application Notes
,
Solid State Research
Elucidate the Crystal Structure of a Poorly Crystalline Compound in 2 Weeks with MicroED and Targeted CSP
Application Notes
,
Case Studies
,
Solid State Research
Crystal Structure Prediction (CSP) De-risks Polymorph Instability by Providing a Deep Insight Into All Stable Forms
03
Publications
Explore all
Publications
,
Solid State Research
Templated Nucleation of Clotrimazole and Ketoprofen on Polymer Substrates
Publications
,
Solid State Research
Tale of Two Polymorphs: Investigating the Structural Differences and Dynamic Relationship between Nirmatrelvir Solid Forms (Paxlovid)
Publications
,
Solid State Research
Cocrystal Synthesis through Crystal Structure Prediction
Publications
,
Solid State Research
,
Solid State Research
Effect of Polymer Additives on the Crystal Habit of Metformin HCl
04
Webinars
Explore all
Solid-State R&D Series
,
Webinars
Intelligent Cloud-Based Algorithms for Pharmaceutical Drug Formulation and Development
05
News & Events
Explore all
News
XtalPi Advances Global STEM Education Through AI-Powered Science Outreach
News
XtalPi Sweeps Prestigious Awards, Earning Global Recognition for AI Innovation
News
XtalPi Partners with UCB to Accelerate Next-Gen Biologic Development via AI-Powered XtalFold™ Platform
Search XtalPi
Search
Publications
,
Solid State Research
Templated Nucleation of Clotrimazole and Ketoprofen on Polymer Substrates
Publications
,
Solid State Research
Tale of Two Polymorphs: Investigating the Structural Differences and Dynamic Relationship between Nirmatrelvir Solid Forms (Paxlovid)
Publications
,
Solid State Research
Cocrystal Synthesis through Crystal Structure Prediction
Software
PatSight
Patent Extraction tool
XFEP
High Accuracy Free Energy Calculation Tool
XMolGen
Generative Chemistry Tool
Drug Discovery
Hit Discovery
Hit or Lead Optimization
Biology Capabilities
Discovery Chemistry
Automation-aided Chemical Synthesis
Focused Library
Building Blocks
Solid State Research
XtalGazer™
Solid State Research Solution
Experimental Solid-State R&D
Solid-State Chemistry Computational Solutions
Crystal Structure Determination
Solutions
Software
PatSight
XFEP
XMolGen
Drug Discovery
Hit Discovery
Hit or Lead Optimization
Biology Capabilities
Discovery Chemistry
Automation-aided Chemical Synthesis
Focused Library
Solid State Research
XtalGazer™
Experimental Solid State R&D
Solid-State Chemistry Computational Solutions
Crystal Structure Determination
Our Approach
Digital Chemistry
Drug Discovery
Technology
AI & Quantum Physics
Automation and Digitalization
Resources
Case studies
Publications
Webinars
About Us
Careers
News & Events
Culture
Brands
Investor Relationship
Solutions
Software
PatSight
XFEP
XMolGen
Drug Discovery
Hit Discovery
Hit or Lead Optimization
Biology Capabilities
Discovery Chemistry
Automation-aided Chemical Synthesis
Focused Library
Solid State Research
XtalGazer™
Experimental Solid State R&D
Solid-State Chemistry Computational Solutions
Crystal Structure Determination
Our Approach
Digital Chemistry
Drug Discovery
Technology
AI & Quantum Physics
Automation and Digitalization
Resources
Case studies
Publications
Webinars
About Us
Careers
News & Events
Culture
Brands
Investor Relationship
Get started
XtalPi Newsletter