GDB-11: Chemical Universe Database (26.4M Molecules)
A dataset card for the Generated Database 11 (GDB-11), a database of 26.4 million small organic molecules for virtual …
Datasets
GDB-13: Chemical Universe Database (970M Molecules)
A dataset card for the Generated Database 13 (GDB-13), a database of nearly 1 billion small organic molecules for …
GDB-17: Chemical Universe Database (166B Molecules)
A dataset card for the Generated Database 17 (GDB-17), containing 166 billion small organic molecules representing the …
Beyond 2D: Exploring the GEOM Dataset for 3D Molecular Conformer Generation
Learn how GEOM transforms 2D molecular graphs into dynamic 3D conformer ensembles for molecular machine learning …
Sarcasm Detection with Transformers: A Cautionary Tale
Learn how dataset bias can lead to misleading results in NLP: a sarcasm detection model that actually learned to …
Mini-Protein Trajectory Generation
GROMACS simulation workflows for generating amino acid dipeptide trajectories across nine different residue types, …
Congressional Data Analysis & Classification
Comprehensive data science project that scraped 47,000+ congressional bills, analyzed legislative patterns, and built ML …...
NewsTweet Dataset: Social Media in Digital Journalism
Describes the creation of NewsTweet, a large-scale dataset and pipeline for studying embedded tweets in online news. …...
QuAC: Question Answering in Context Dataset
An analysis of QuAC's approach to conversational question answering through student-teacher interactions, featuring …
CoQA Dataset: Advancing Conversational Question Answering
An analysis of CoQA, a conversational QA dataset that introduces multi-turn dialogue, coreference resolution, and …