SAIR: Accelerating Pharma R&D with AI-Powered Structural Intelligence
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35
AI & ML interests
Building Large Quantitative Models (LQMs) to solve the world's most complex challenges with AI
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omaraq
updated
a
dataset
18 minutes ago
omaraq
published
a
dataset
about 2 months ago
aayushrs-aq
updated
a
dataset
about 2 months ago
Post
5692
🚀🚀🚀 The largest ever dataset of co-folded 3D protein-ligand structures just dropped on HF!!
Meet SAIR (Structurally Augmented IC₅₀ Repository): 5M+ AI-generated complexes with experimentally measured drug potency data from SandboxAQ. 🚀🚀🚀
Check it out and explore here: SandboxAQ/SAIR
Meet SAIR (Structurally Augmented IC₅₀ Repository): 5M+ AI-generated complexes with experimentally measured drug potency data from SandboxAQ. 🚀🚀🚀
Check it out and explore here: SandboxAQ/SAIR
- 3 replies
Post
613
Just dropped the most influential materials science data of the year so far! Check it out :)))
cgeorgiaw/WyFormer-Symmetric-Crystals
cgeorgiaw/WyFormer-Symmetric-Crystals
- 1 reply
Post
2769
Huge new bio datasets just dropped!!!
Check out them out @
ginkgo-datapoints
Read the blog for more info: https://huggingface.co/blog/cgeorgiaw/gdp
Check out them out @
ginkgo-datapoints
Read the blog for more info: https://huggingface.co/blog/cgeorgiaw/gdp
- 1 reply
Post
1597
Snooping on HF is the best because sometimes you just discover that someone (in this case, Earth Species Project) is about to drop terabytes of sick (high quality animal sounds) data...
EarthSpeciesProject/NatureLM-audio-training
EarthSpeciesProject/NatureLM-audio-training
Post
501
Just dropped two bigger physics datasets (both on photonics)!
NUMBA 1: SIB-CL
This dataset of Surrogate- and Invariance-Boosted Contrastive Learning (SIB-CL) datasets for two scientific problems:
- PhC2D: 2D photonic crystal density-of-states (DOS) and bandstructure data.
- TISE: 3D time-independent Schrödinger equation eigenvalue and eigenvector solutions.
NUMBA2: 2D Photonic Topology
Symmetry-driven analysis of 2D photonic crystals: 10k random unit cells across 11 symmetries, 2 polarizations, 5 contrasts. Includes time-reversal breaking cases for 4 symmetries at high contrast.
Check them out: cgeorgiaw/sib-cl & cgeorgiaw/2d-photonic-topology
NUMBA 1: SIB-CL
This dataset of Surrogate- and Invariance-Boosted Contrastive Learning (SIB-CL) datasets for two scientific problems:
- PhC2D: 2D photonic crystal density-of-states (DOS) and bandstructure data.
- TISE: 3D time-independent Schrödinger equation eigenvalue and eigenvector solutions.
NUMBA2: 2D Photonic Topology
Symmetry-driven analysis of 2D photonic crystals: 10k random unit cells across 11 symmetries, 2 polarizations, 5 contrasts. Includes time-reversal breaking cases for 4 symmetries at high contrast.
Check them out: cgeorgiaw/sib-cl & cgeorgiaw/2d-photonic-topology
cgeorgiaw
authored
4
papers
5 months ago
Toward Robust Real-World Audio Deepfake Detection: Closing the Explainability Gap
Paper
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2410.07436
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Published
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1
Fact-Checking with Contextual Narratives: Leveraging Retrieval-Augmented LLMs for Social Media Analysis
Paper
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2504.10166
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Published
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2
PSyDUCK: Training-Free Steganography for Latent Diffusion
Paper
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2501.19172
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Published
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1
LLM-Consensus: Multi-Agent Debate for Visual Misinformation Detection
Paper
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2410.20140
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Published
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1