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Journal Articles
- 2023
[j6]Carlos Borau
, Kenneth Y. Wertheim, Silvia Hervas-Raluy, Diego Sainz-DeMena, Dawn C. Walker, Robert Chisholm, Paul Richmond, V. Varella, Marco Viceconti, A. Montero, Elisabet Gregori-Puigjané, Jordi Mestres, Marek Kasztelnik, José Manuel García-Aznar:
A multiscale orchestrated computational framework to reveal emergent phenomena in neuroblastoma. Comput. Methods Programs Biomed. 241: 107742 (2023)- 2016
- [j5]Kazi Yasin Helal, Mateusz Maciejewski, Elisabet Gregori-Puigjané, Meir Glick, Anne Mai Wassermann:
Public Domain HTS Fingerprints: Design and Evaluation of Compound Bioactivity Profiles from PubChem's Bioassay Repository. J. Chem. Inf. Model. 56(2): 390-398 (2016) - 2012
- [j4]Elisabet Gregori-Puigjané, Rut Garriga-Sust, Jordi Mestres:
Response to the comment by Wolf Ihlenfeldt on the paper "Indexing molecules with chemical graph identifiers". J. Comput. Chem. 33(2): 238 (2012) - 2011
- [j3]Elisabet Gregori-Puigjané, Rut Garriga-Sust, Jordi Mestres:
Indexing molecules with chemical graph identifiers. J. Comput. Chem. 32(12): 2638-2646 (2011) - 2006
- [j2]Elisabet Gregori-Puigjané, Jordi Mestres:
SHED: Shannon Entropy Descriptors from Topological Feature Distributions. J. Chem. Inf. Model. 46(4): 1615-1622 (2006) - [j1]Jordi Mestres, Lidia Martín-Couce, Elisabet Gregori-Puigjané, Montserrat Cases, Scott Boyer:
Ligand-Based Approach to In Silico Pharmacology: Nuclear Receptor Profiling. J. Chem. Inf. Model. 46(6): 2725-2736 (2006)
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