The project aims to integrate ConPLex for target selection and ESM for target validation into DeepChem, addressing the need for target selection and...
Developing Modality Support for PROTACs
David_Zhang
PROTACs represent a very promising emerging drug modalities. Traditional modalities, small-molecule drugs, for example, or monoclonal antibodies, are...
Incorporating Polymer Representation in DeepChem for Drug Delivery and Material Science Support
Debasish Mohanty
Current methods in the DeepChem library struggle to understand complex polymers, limiting their application in drug delivery and materials science....
Target Conditioned Antibody Sequence Generation Using Protein Language Models
Dhuvi Karthikeyan
Monoclonal antibodies (mAbs) are a potent therapeutic because of their ability to precisely target molecular surfaces at a sub-protein level...
DeepChem meets Hugging Face pLM ESM-2: Predicting protein binding sites. A tutorial.
Elisa Gómez de Lope
Protein-ligand interactions play a crucial role in various biological processes, and accurately predicting protein binding sites, where ligand...
Torch compile and PyTorch 2.2.0
Gautham Krishnan P
This project aims to integrate the torch.compile function released in PyTorch 2.0 into DeepChem's PyTorch models, unlocking significant performance...
Porting the Smiles2Vec Model from Tensorflow to Pytorch
Harishwar Adithya S
In this project, we aim to port DeepChem Models from Tensorflow to Pytorch. I want to select Chemnet Models model to work with. I want to put the...
Protein Language Modeling
Shivasankaran Vanaja Pandi
The project aims to integrate a protein language model (PLM) into the DeepChem library through HuggingFace APIs and PyTorch. The project would...
