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Biotech insights for the future

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Case Studies

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

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Publications

Publications

AI-Predicted Full-Spectrum UV Correction Factors: An Analyte-Standard-Free Framework for Reaction Yield Quantification

Discovery Chemistry, Publications

SureRoute: Toward a Hallucination-Free Self-Improving Platform for Retrosynthesis

Publications, Solid State Research

Selective pore modulation in layered molecular crystals

Publications

Synthesis of Z‑allylamines via masked alkenyl anions from alkynyl tetracoordinate boron compounds

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Video Library

Video Library

Unlock Faster, Smarter Polymorph Screening with XtalGazer™ CSP

Video Library

Unlock Faster, More Accurate Drug Discovery with XFEP

Solid-State R&D Series, Video Library

Intelligent Cloud-Based Algorithms for Pharmaceutical Drug Formulation and Development

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News & Events

News

Ailux Presents New Preclinical Data Supporting its Long-Acting IL-4Rα Antibody and Expanding its Bispecific Applications at EADV 2026

News

XtalPi Debuts Kodexia™, the World’s First Closed-Loop siRNA Platform Combining Generative AI with First-Principles Modeling

News

XtalPi Advances Hair Loss Drug Program into IND-Enabling Studies