Laura Guasch

According to our database, Laura Guasch authored at least 7 papers between 2011 and 2021.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2021

The Playbooks of Medicinal Chemistry Design Moves.

Mahendra Awale, Jérôme Hert, Laura Guasch, Sereina Riniker, Christian Kramer

J. Chem. Inf. Model., 2021

2020

Tautomer Database: A Comprehensive Resource for Tautomerism Analyses.

Devendra K. Dhaked, Laura Guasch, Marc C. Nicklaus

J. Chem. Inf. Model., 2020

2018

Exploring Deep Recurrent Models with Reinforcement Learning for Molecule Design.

Daniel Neil, Marwin H. S. Segler, Laura Guasch, Mohamed Ahmed, Dean Plumbley, Matthew Sellwood, Nathan Brown

Proceedings of the 6th International Conference on Learning Representations, 2018

2016

Experimental and Chemoinformatics Study of Tautomerism in a Database of Commercially Available Screening Samples.

Laura Guasch, Waruna Yapamudiyansel, Megan L. Peach, James A. Kelley, Joseph J. Barchi, Marc C. Nicklaus

J. Chem. Inf. Model., 2016

2014

Enumeration of Ring-Chain Tautomers Based on SMIRKS Rules.

Laura Guasch, Markus Sitzmann, Marc C. Nicklaus

J. Chem. Inf. Model., 2014

2012

DecoyFinder: an easy-to-use python GUI application for building target-specific decoy sets.

Adrià Cereto-Massagué, Laura Guasch, Cristina Valls, Miquel Mulero, Gerard Pujadas, Santiago Garcia-Vallvé

Bioinform., 2012

2011

Structural insights for the design of new PPARgamma partial agonists with high binding affinity and low transactivation activity.

Laura Guasch, Esther Sala, Cristina Valls, Mayte Blay, Miquel Mulero, Lluís Arola, Gerard Pujadas, Santiago Garcia-Vallvé

J. Comput. Aided Mol. Des., 2011