activity
20142023
most citedRamanSPy: An open-source Python package for integrative Raman spectroscopy data analysis

73 citations · 113 across the 7 of their papers we have counts for

collaborators

7 papers

cond-mat.mtrl-sci2023★ 73 cited

RamanSPy: An open-source Python package for integrative Raman spectroscopy data analysis

Dimitar Georgiev, Simon Vilms Pedersen, Ruoxiao Xie +3

Raman spectroscopy is a non-destructive and label-free chemical analysis technique, which plays a key role in the analysis and discovery cycle of various branches of science. Nonet…

stat.ML2023★ 1 cited

Interaction Measures, Partition Lattices and Kernel Tests for High-Order Interactions

Zhaolu Liu, Robert L. Peach, Pedro A. M. Mediano +1

Models that rely solely on pairwise relationships often fail to capture the complete statistical structure of the complex multivariate data found in diverse domains, such as socio-…

stat.ME2023

Kernel-based Joint Independence Tests for Multivariate Stationary and Non-stationary Time Series

Zhaolu Liu, Robert L. Peach, Felix Laumann +2

Multivariate time series data that capture the temporal evolution of interconnected systems are ubiquitous in diverse areas. Understanding the complex relationships and potential d…

cs.LG2022★ 1 cited

ICE-NODE: Integration of Clinical Embeddings with Neural Ordinary Differential Equations

Asem Alaa, Erik Mayer, Mauricio Barahona

Early diagnosis of disease can lead to improved health outcomes, including higher survival rates and lower treatment costs. With the massive amount of information available in elec…

q-bio.BM2022

Prediction of protein allosteric signalling pathways and functional residues through paths of optimised propensity

Nan Wu, Sophia N. Yaliraki, Mauricio Barahona

Allostery commonly refers to the mechanism that regulates protein activity through the binding of a molecule at a different, usually distal, site from the orthosteric site. The omn…

cs.LG2021★ 1 cited

Similarity measure for sparse time course data based on Gaussian processes

Zijing Liu, Mauricio Barahona

We propose a similarity measure for sparsely sampled time course data in the form of a log-likelihood ratio of Gaussian processes (GP). The proposed GP similarity is similar to a B…

q-bio.BM2014★ 37 cited

Uncovering allosteric pathways in caspase-1 with Markov transient analysis and multiscale community detection

B. Amor, S. N. Yaliraki, R. Woscholski +1

Allosteric regulation at distant sites is central to many cellular processes. In particular, allosteric sites in proteins are a major target to increase the range and selectivity o…