| Year |
Citation |
Score |
| 2024 |
Hansen AL, Theisen FF, Crehuet R, Marcos E, Aghajari N, Willemoës M. Carving out a Glycoside Hydrolase Active Site for Incorporation into a New Protein Scaffold Using Deep Network Hallucination. Acs Synthetic Biology. PMID 38357862 DOI: 10.1021/acssynbio.3c00674 |
0.615 |
|
| 2018 |
Dou J, Vorobieva AA, Sheffler W, Doyle LA, Park H, Bick MJ, Mao B, Foight GW, Lee MY, Gagnon LA, Carter L, Sankaran B, Ovchinnikov S, Marcos E, Huang PS, et al. De novo design of a fluorescence-activating β-barrel. Nature. PMID 30209393 DOI: 10.1038/S41586-018-0509-0 |
0.323 |
|
| 2017 |
Marcos E, Basanta B, Chidyausiku TM, Tang Y, Oberdorfer G, Liu G, Swapna GV, Guan R, Silva DA, Dou J, Pereira JH, Xiao R, Sankaran B, Zwart PH, Montelione GT, et al. Principles for designing proteins with cavities formed by curved β sheets. Science (New York, N.Y.). 355: 201-206. PMID 28082595 DOI: 10.1126/Science.Aah7389 |
0.32 |
|
| 2017 |
Torrent-Sucarrat M, Navarro S, Marcos E, Anglada JM, Luis JM. Design of Hückel–Möbius Topological Switches with High Nonlinear Optical Properties The Journal of Physical Chemistry C. 121: 19348-19357. DOI: 10.1021/Acs.Jpcc.7B05900 |
0.588 |
|
| 2014 |
Marcos E, Anglada JM, Torrent-Sucarrat M. Effect of the meso-substituent in the Hückel-to-Möbius topological switches. The Journal of Organic Chemistry. 79: 5036-46. PMID 24816245 DOI: 10.1021/Jo500569P |
0.596 |
|
| 2013 |
Sanchez-Martinez M, Marcos E, Tauler R, Field M, Crehuet R. Conformational compression and barrier height heterogeneity in the N-acetylglutamate kinase. The Journal of Physical Chemistry. B. 117: 14261-72. PMID 24147751 DOI: 10.1021/Jp407016V |
0.709 |
|
| 2012 |
Marcos E, Jiménez A, Crehuet R. Dynamic Fingerprints of Protein Thermostability Revealed by Long Molecular Dynamics. Journal of Chemical Theory and Computation. 8: 1129-42. PMID 26593372 DOI: 10.1021/Ct200877Z |
0.656 |
|
| 2012 |
Marcos E, Anglada JM, Torrent-Sucarrat M. Theoretical Study of the Switching between Hückel and Möbius Topologies for Expanded Porphyrins The Journal of Physical Chemistry C. 116: 24358-24366. DOI: 10.1021/Jp3083612 |
0.604 |
|
| 2011 |
Marcos E, Mestres P, Crehuet R. Crowding induces differences in the diffusion of thermophilic and mesophilic proteins: a new look at neutron scattering results. Biophysical Journal. 101: 2782-9. PMID 22261067 DOI: 10.1016/J.Bpj.2011.09.033 |
0.661 |
|
| 2011 |
Marcos E, Crehuet R, Bahar I. Changes in dynamics upon oligomerization regulate substrate binding and allostery in amino acid kinase family members. Plos Computational Biology. 7: e1002201. PMID 21980279 DOI: 10.1371/Journal.Pcbi.1002201 |
0.667 |
|
| 2010 |
Marcos E, Field MJ, Crehuet R. Pentacoordinated phosphorus revisited by high-level QM/MM calculations. Proteins. 78: 2405-11. PMID 20602355 DOI: 10.1002/Prot.22758 |
0.696 |
|
| 2010 |
Marcos E, Crehuet R, Bahar I. On the conservation of the slow conformational dynamics within the amino acid kinase family: NAGK the paradigm. Plos Computational Biology. 6: e1000738. PMID 20386738 DOI: 10.1371/Journal.Pcbi.1000738 |
0.665 |
|
| 2008 |
Marcos E, Crehuet R, Anglada JM. Inductive and External Electric Field Effects in Pentacoordinated Phosphorus Compounds. Journal of Chemical Theory and Computation. 4: 49-63. PMID 26619979 DOI: 10.1021/Ct700220Z |
0.68 |
|
| 2008 |
Marcos E, Anglada JM, Crehuet R. Description of pentacoordinated phosphorus under an external electric field: which basis sets and semi-empirical methods are needed? Physical Chemistry Chemical Physics : Pccp. 10: 2442-50. PMID 18446244 DOI: 10.1039/B719792F |
0.683 |
|
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