| Role of glutamine synthetase in angiogenesis beyond glutamine synthesis G Eelen, C Dubois, AR Cantelmo, J Goveia, U Brüning, M DeRan, ... Nature 561 (7721), 63-69, 2018 | 156 | 2018 |
| Protein CoAlation and antioxidant function of coenzyme A in prokaryotic cells Y Tsuchiya, A Zhyvoloup, J Baković, N Thomas, BYK Yu, S Das, C Orengo, ... Biochemical Journal 475 (11), 1909-1937, 2018 | 68 | 2018 |
| GABA binding to an insect GABA receptor: a molecular dynamics and mutagenesis study JA Ashby, IV McGonigle, KL Price, N Cohen, F Comitani, DA Dougherty, ... Biophysical Journal 103 (10), 2071-2081, 2012 | 59 | 2012 |
| Exploring cryptic pockets formation in targets of pharmaceutical interest with SWISH F Comitani, FL Gervasio Journal of chemical theory and computation 14 (6), 3321-3331, 2018 | 46 | 2018 |
| The free energy landscape of GABA binding to a pentameric ligand-gated ion channel and its disruption by mutations F Comitani, V Limongelli, C Molteni Journal of Chemical Theory and Computation, 2016 | 45 | 2016 |
| Lineage-defined leiomyosarcoma subtypes emerge years before diagnosis and determine patient survival ND Anderson, Y Babichev, F Fuligni, F Comitani, M Layeghifard, ... Nature communications 12 (1), 4496, 2021 | 37 | 2021 |
| Tunable heat transfer with smart nanofluids M Bernardin, F Comitani, A Vailati Physical Review E 85 (6), 066321, 2012 | 36 | 2012 |
| A multiscale simulation approach to modeling drug–protein binding kinetics S Haldar, F Comitani, G Saladino, C Woods, MW van der Kamp, ... Journal of chemical theory and computation 14 (11), 6093-6101, 2018 | 34 | 2018 |
| Single cell derived mRNA signals across human kidney tumors MD Young, TJ Mitchell, L Custers, T Margaritis, F Morales-Rodriguez, ... Nature Communications 12 (1), 3896, 2021 | 32 | 2021 |
| The clinical utility of integrative genomics in childhood cancer extends beyond targetable mutations A Villani, S Davidson, N Kanwar, WW Lo, Y Li, S Cohen-Gogo, F Fuligni, ... Nature Cancer 4 (2), 203-221, 2023 | 31 | 2023 |
| Defining an optimal metric for the path collective variables L Hovan, F Comitani, FL Gervasio Journal of Chemical Theory and Computation 15 (1), 25-32, 2018 | 31 | 2018 |
| Insights into the binding of GABA to the insect RDL receptor from atomistic simulations: a comparison of models F Comitani, N Cohen, J Ashby, D Botten, SCR Lummis, C Molteni Journal of computer-aided molecular design 28, 35-48, 2014 | 27 | 2014 |
| Mapping the conformational free energy of aspartic acid in the gas phase and in aqueous solution F Comitani, K Rossi, M Ceriotti, ME Sanz, C Molteni The Journal of chemical physics 146 (14), 2017 | 13 | 2017 |
| Elucidating ligand binding and channel gating mechanisms in pentameric ligand-gated ion channels by atomistic simulations F Comitani, C Melis, C Molteni Biochemical Society Transactions 43 (2), 151-156, 2015 | 13 | 2015 |
| Widespread hypertranscription in aggressive human cancers M Zatzman, F Fuligni, R Ripsman, T Suwal, F Comitani, LM Edward, ... Science advances 8 (47), eabn0238, 2022 | 12 | 2022 |
| Mutagenesis computer experiments in pentameric ligand-gated ion channels: the role of simulation tools with different resolution A Crnjar, F Comitani, C Melis, C Molteni Interface Focus 9 (3), 20180067, 2019 | 12 | 2019 |
| Trans–Cis Proline Switches in a Pentameric Ligand-Gated Ion Channel: How They Are Affected by and How They Affect the Biomolecular Environment A Crnjar, F Comitani, W Hester, C Molteni The Journal of Physical Chemistry Letters 10 (3), 694-700, 2019 | 10 | 2019 |
| Diagnostic classification of childhood cancer using multiscale transcriptomics F Comitani, JO Nash, S Cohen-Gogo, AI Chang, TT Wen, A Maheshwari, ... Nature medicine 29 (3), 656-666, 2023 | 9 | 2023 |
| Extraction and high-throughput sequencing of oak heartwood DNA: Assessing the feasibility of genome-wide DNA methylation profiling F Rossi, A Crnjar, F Comitani, R Feliciano, L Jahn, G Malim, L Southgate, ... Plos one 16 (11), e0254971, 2021 | 3 | 2021 |
| Modeling ligand–target binding with enhanced sampling simulations F Comitani, FL Gervasio Biomol. Simul. Struct. Based Drug Discov, 43-66, 2019 | 3 | 2019 |
Carla MolteniKing's College London, Physics DepartmentEmail verificata su kcl.ac.uk
