Molecular insights from conformational ensembles via machine learning O Fleetwood, MA Kasimova, AM Westerlund, L Delemotte Biophysical Journal 118 (3), 765-780, 2020 | 72 | 2020 |
Effect of Ca2+ on the promiscuous target-protein binding of calmodulin AM Westerlund, L Delemotte PLoS computational biology 14 (4), e1006072, 2018 | 64 | 2018 |
Calmodulin acts as a state-dependent switch to control a cardiac potassium channel opening PW Kang, AM Westerlund, J Shi, KMF White, AK Dou, AH Cui, JR Silva, ... Science advances 6 (50), eabd6798, 2020 | 36 | 2020 |
Risk prediction of cardiovascular events by exploration of molecular data with explainable artificial intelligence AM Westerlund, JS Hawe, M Heinig, H Schunkert International Journal of Molecular Sciences 22 (19), 10291, 2021 | 32 | 2021 |
InfleCS: clustering free energy landscapes with Gaussian mixtures AM Westerlund, L Delemotte Journal of chemical theory and computation 15 (12), 6752-6759, 2019 | 32 | 2019 |
Network analysis reveals how lipids and other cofactors influence membrane protein allostery AM Westerlund, O Fleetwood, S Perez-Conesa, L Delemotte The Journal of Chemical Physics 153 (14), 2020 | 22 | 2020 |
Inference of calmodulin's Ca2+-dependent free energy landscapes via Gaussian Mixture Model Validation AM Westerlund, TJ Harpole, C Blau, L Delemotte Biophysical Journal 114 (3), 675a, 2018 | 19 | 2018 |
Tracking the motion of the KV1.2 voltage sensor reveals the molecular perturbations caused by a de novo mutation in a case of epilepsy A Pantazis, M Kaneko, M Angelini, F Steccanella, AM Westerlund, ... The Journal of physiology 598 (22), 5245-5269, 2020 | 11 | 2020 |
Data‐driven approaches for identifying hyperparameters in multi‐step retrosynthesis AM Westerlund, B Barge, L Mervin, S Genheden Molecular Informatics 42 (11), e202300128, 2023 | 1 | 2023 |
Markov state modelling reveals heterogeneous drug-inhibition mechanism of Calmodulin AM Westerlund, A Sridhar, L Dahl, A Andersson, AY Bodnar, L Delemotte PLoS Computational Biology 18 (10), e1010583, 2022 | 1 | 2022 |
Deciphering conformational ensembles and communication pathways in biomolecules AM Westerlund A&C Black Publishers Ltd., 2020 | 1 | 2020 |
Recursive Bayesian Estimation Applied to Autonomous Vehicles A Westerlund, HJ Larsson | 1 | 2015 |
Do Chemformers Dream of Organic Matter? Evaluating a Transformer Model for Multistep Retrosynthesis AM Westerlund, S Manohar Koki, S Kancharla, A Tibo, L Saigiridharan, ... Journal of Chemical Information and Modeling, 2023 | | 2023 |
Calmodulin Functionally Couples the KCNQ1 Channel Voltage-Sensing and Pore Domains PW Kang, AM Westerlund, J Shi, KMF White, AK Dou, JR Silva, ... Biophysical Journal 118 (3), 332a-333a, 2020 | | 2020 |
A De Novo Mutation Associated with Epilepsy Enhances KV1. 2 Voltage Dependence, Suppressing Neuronal Excitability A Pantazis, M Kaneko, AM Westerlund, L Delemotte, S Saitta, R Olcese Biophysical Journal 116 (3), 247a, 2019 | | 2019 |
Multiscale biophysical investigation of a novel KCNA2 (KV1. 2) variant associated with epilepsy A Pantazis, M Kaneko, AM Westerlund, L Delemotte, S Saitta, R Olcese Acta Physiologica 227, 64-64, 2019 | | 2019 |
On the Selective Promiscuity of Calmodulin AM Westerlund, L Delemotte Biophysical Journal 114 (3), 7a-8a, 2018 | | 2018 |
Computational Study of Calmodulin’s Ca2+-dependent Conformational Ensembles AM Westerlund Kungliga Tekniska högskolan, 2018 | | 2018 |
Optimization of Extended Warranties-A Model in a Centralized Supply Chain Environment J Bertilsson, G Ljungqvist, A Vedadi, A Westerlund | | 2013 |