179 citations · 180 across the 3 of their papers we have counts for
3 papers
cs.LG2021
AugLiChem: Data Augmentation Library of Chemical Structures for Machine Learning
Rishikesh Magar, Yuyang Wang, Cooper Lorsung +4
Machine learning (ML) has demonstrated the promise for accurate and efficient property prediction of molecules and crystalline materials. To develop highly accurate ML models for c…
cs.LG2018★ 1 cited
bigMap: Big Data Mapping with Parallelized t-SNE
Joan Garriga, Frederic Bartumeus
We introduce an improved unsupervised clustering protocol specially suited for large-scale structured data. The protocol follows three steps: a dimensionality reduction of the data…
q-bio.QM2015★ 179 cited
Expectation-Maximization Binary Clustering for Behavioural Annotation
Joan Garriga, John R. Palmer, Aitana Oltra +1
We present a variant of the well sounded Expectation-Maximization Clustering algorithm that is constrained to generate partitions of the input space into high and low values. The m…