Document Processing
Diagram showing page stream segmentation workflow: an input stream of pages is processed through binary classification of page pairs to predict document breaks, producing segmented output documents

LLMs for Page Stream Segmentation

Enhanced TabMe benchmark for page stream segmentation, creating TabMe++, showing fine-tuned decoder-based LLMs …...

Computational Chemistry
Müller-Brown Potential Energy Surface showing the three minima and two saddle points

Müller-Brown Potential

The Müller-Brown potential: a classic two-dimensional analytical benchmark for testing optimization algorithms, reaction …...

Computational Chemistry
Log-scale plot showing exponential growth of alkane isomer counts from C1 to C40

The Number of Isomeric Hydrocarbons of the Methane Series

Henze and Blair's 1931 JACS paper deriving exact recursive formulas for counting alkane isomers and establishing the …

Computational Chemistry
Müller-Brown Potential Energy Surface showing the three minima and two saddle points

High-Performance Müller-Brown Potential: A PyTorch Testbed for Machine Learning and Molecular Dynamics

High-performance, GPU-accelerated PyTorch framework for the Müller-Brown potential, featuring JIT compilation, …...

Computational Chemistry
Müller-Brown Potential Energy Surface showing the three minima and two saddle points

Implementing the Müller-Brown Potential in PyTorch

Guide to implementing the Müller-Brown potential in PyTorch, comparing analytical vs automatic differentiation with …