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List ai4science repositories

A comprehesive survey about foundation models for weather and cliamte data understanding.

Awesome-Scientific-Language-Models

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A Comprehensive Survey of Scientific Large Language Models and Their Applications in Scientific Discovery (EMNLP'24)

DeepZero

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[ICLR'24] "DeepZero: Scaling up Zeroth-Order Optimization for Deep Model Training" by Aochuan Chen*, Yimeng Zhang*, Jinghan Jia, James Diffenderfer, Jiancheng Liu, Konstantinos Parasyris, Yihua Zhang,...

MolDiff

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MolDiff: Addressing the Atom-Bond Inconsistency Problem in 3D Molecule Diffusion Generation

DiffAffinity

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Predicting mutational effects on protein-protein binding via a side-chain diffusion probabilistic model (NeurIPS 2023 Poster)

TaxDiff

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The official code for "TaxDiff: Taxonomic-Guided Diffusion Model for Protein Sequence Generation"

ImageMol

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ImageMol is a molecular image-based pre-training deep learning framework for computational drug discovery.

ECDFormer

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The official code for "Deep peak property learning for efficient chiral molecules ECD spectra prediction"