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Read MoreHit to Lead Discovery of Benzylpiperidine Acetylcholinesterase Inhibitors Using Generative Models: a Restrospective Case Study
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Read MoreEvaluating Computer-assisted Single-step Retrosynthesis
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Read MoreAn Elix Discovery™ Case Study: Rediscovering Donepezil with an In-house Generative Model
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Read MoreAn Elix Discovery™ Case Study: Virtual Screening with Confidence Scores
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Read MoreLeveraging Seif-Supervised Contextual Language Models for Deep Neural Network Antibody CDR-H3 Loop Prediction
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Read MoreUsing Attribution-based Explainability to Guide Deep Molecular Optimization
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Read MoreRetroSynthWAVE: An Open-source Software Platform for Efficient Chemical Synthesis Research
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Read MoreImproving Molecular Property Prediction using Self-supervised Learning
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Read MoreTowards Generating Synthesizable de novo small Molecules
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