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README.md
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# PeptideMTR: MTR-only Variant
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This model is part of the **PeptideMTR** suite, to be released in a forthcoming paper. It is designed for multi-target biochemical property prediction.
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## Overview
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- **Architecture:** MTR-only
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- **Input:** SMILES string (or Amino Acid sequence)
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- **Feature Logic:** Multi-Target Regression using 99 RDKit physicochemical descriptors.
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All models in this suite are designed for simplicity. For inference, the model accepts a SMILES string directly.
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## Usage
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Example scripts can be found at https://github.com/AaronFeller/PeptideMTR
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## Dataset
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The training data and pre-computed 99 RDKit descriptors are available at [PeptideMTR_training_data](https://huggingface.co/datasets/aaronfeller/PeptideMTR_training_data).
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## Citation
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Please cite the forthcoming **PeptideMTR** paper for methodology and benchmark results.
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