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1. ProteinMPNN ProteinMPNN Public

   Forked from dauparas/ProteinMPNN

   Code for the ProteinMPNN paper

   Jupyter Notebook

2. chemprop chemprop Public

   Forked from chemprop/chemprop

   Message Passing Neural Networks for Molecule Property Prediction

   Python

3. MultiModalSpectralTransformer MultiModalSpectralTransformer Public

   Forked from mpriessner/MultiModalSpectralTransformer

   This is the code associated to the paper about the MultiModalSpectralTransformer, capable of predicting molecules from spectral data (1H, 13C, HSQC, COSY, IR).

   Jupyter Notebook

4. awesome-ChemicalSpectraAI awesome-ChemicalSpectraAI Public

   Forked from AspirinCode/awesome-ChemicalSpectraAI

   AI for Chemical Spectra

5. papers-for-molecular-design-using-DL papers-for-molecular-design-using-DL Public

   Forked from AspirinCode/papers-for-molecular-design-using-DL

   List of Molecular and Material design using Generative AI and Deep Learning

6. SCP-Lab SCP-Lab Public

   Forked from InternRobotics/SCP-Lab

   Python