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Lead Discovery & Optimization
Hit Identification
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Fragment-based Screening (FBS)
MagHelix™ Library Design and Preparation
High-throughput Screening (HTS)
High-content Screening (HCS)
MagHelix™ HTS Assay Development
Hit to Lead
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Hit Biophysical Characterization
Fragment-to-Lead
Pharmacophore Modeling
Lead Optimization
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Structure-Guided Medicinal Chemistry and Synthesis
Structure-Activity Relationship (SAR) Analysis
Lead Preclinical Development
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In Vitro ADME-Tox Profiling
NMR-based Pharmacometabonomics
Zebrafish Services
Natural Product Research & Development
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Natural Product Identification
Natural Product Production & Extraction
Computational Biology & AI
CADD, Docking & Virtual Screening
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Virtual Screening Services
Molecular Docking Services
Pharmacophore Modeling & Screening
Drug Design & Library Analysis
Molecular Dynamics (MD) Simulations
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Binding Free Energy Calculation (FEP/TI, MM/PBSA)
All-Atom Protein MD Simulation
Membrane Protein & Lipid MD Simulation
Nucleic Acid (DNA/RNA) MD Simulation
Replica Exchange Molecular Dynamics (REMD)
Coarse-Grained (CG) MD Simulation
AI for Antibody & Biologics
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In Silico Antibody Humanization
Antibody Affinity Maturation (AI-Assisted)
Antibody Aggregation & Solubility Prediction
Epitope Mapping & Paratope Prediction
ADMET Prediction & Modeling
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AI-Based Toxicity Prediction (hERG, Ames, Carcinogenicity)
Metabolism & Stability Prediction
AI-Based Structure Prediction & Analysis
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AlphaFold Protein Structure Prediction
Homology Modeling & Threading
Ab Initio Modeling & Co-evolutionary Analysis
Structure Refinement & Quality Assessment
Structural Data Processing Services
Binding Pocket & Druggability Analysis (Combination pocket drugability analysis)
Complex Structure Prediction (Protein-Protein/Peptide Interaction Modeling)
Antibody Structure Prediction (IgFold/DeepAb)
AI-Enhanced Structural Analysis
Target Protein Production
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Gene-to-Protein Production
Crystal Grade Protein Preparation
AI-Assisted X-ray Crystallography Services
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Virtual Co-Crystal Screening Services
MagHelix™ Co-crystallization and Soaking
AI-Enhanced Cryo-Electron Microscopy (Cryo-EM) Services
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Single Particle Analysis (SPA)
Micro-ED Services
AI-Enhanced NMR Spectroscopy Services
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Fragment Screening by NMR (STD-NMR)
Protein Structure Determination by NMR
MagHelix™ Saturation Transfer Difference (STD) NMR
Platforms
MagHelix™ Structural Biology and SBDD Platform
MagHelix™ CADD Platform
MagHelix™ FBDD Platform
MagHelix™ AI-Based Drug Discovery (AIDD) Platform
MagHelix™ Zebrafish Screening Platform
AI-based Drug Discovery Platform
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Careers
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Project Manager-Drug Discovery
Research Scientist-Structural Analysis
Principal Scientist-Drug Discovery
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