Zhichen's repositories

AI2BMD

AI-powered ab initio biomolecular dynamics simulation

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AlphaDrug

AlphaDrug: Protein Target Specific De Novo Molecular Generation

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annotated-transformer

An annotated implementation of the Transformer paper.

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attention-is-all-you-need-pytorch

A PyTorch implementation of the Transformer model in "Attention is All You Need".

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axial-attention

Implementation of Axial attention - attending to multi-dimensional data efficiently

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ChemTSv2

Refined and extended version of ChemTS

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Crossformer

Official implementation of our ICLR 2023 paper "Crossformer: Transformer Utilizing Cross-Dimension Dependency for Multivariate Time Series Forecasting"

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DeepAb

Deep learning models and structure realization scripts for the DeepAb antibody structure prediction method.

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fairseq

Facebook AI Research Sequence-to-Sequence Toolkit written in Python.

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FFiNet

Force field-inspired molecular representation learning model

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FourierGNN

Official implementation of the paper "FourierGNN: Rethinking Multivariate Time Series Forecasting from a Pure Graph Perspective"

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ImmuneBuilder

Predict the structure of immune receptor proteins

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mctx

Monte Carlo tree search in JAX

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MolGen

[ICLR 2024] Domain-Agnostic Molecular Generation with Chemical Feedback

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multi-task-continual-learning

joint training of slot and intent detection based on Bert model

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neural_prophet

NeuralProphet: A simple forecasting package

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Pocket2Mol

Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets

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PocketGen

Implementation of PocketGen: Generating Full-Atom Ligand-Binding Protein Pockets

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reinvent-hitl

Code for paper "Human-in-the-Loop Assisted de Novo Molecular Design".

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SyntheMol

Combinatorial antibiotic generation

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TDC

Therapeutics Commons: Artificial Intelligence Foundation for Therapeutic Science

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terminator

multiple GNOME terminals in one window

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