Manuel Pastor

According to our database, Manuel Pastor authored at least 20 papers between 1994 and 2024.

Collaborative distances:

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

2024

A scalable well-balanced numerical scheme for the modeling of two-phase shallow granular landslide consolidation.

Federico Gatti, Carlo de Falco, Simona Perotto, Luca Formaggia, Manuel Pastor

J. Comput. Phys., March, 2024

Integrating Mechanistic and Toxicokinetic Information in Predictive Models of Cholestasis.

Pablo Rodríguez-Belenguer, Victor Mangas-Sanjuan, Emilio Soria-Olivas, Manuel Pastor

J. Chem. Inf. Model., 2024

Innovative Digital Forensic and Investigation Tools for Law Enforcement: The EMPOWER & TRACY Approach.

Nikos Avgerinos, Panagiotis Mertis, Manolis Tsagaris, Nikos Desipris, George L. Lyberopoulos, Elina Theodoropoulou, Konstantinos Filis, Jelena Sarajlic, Manuel Pastor, Despoina Chatzakou, George Kalpakis, Christos Chatzikonstantinou, Dorothea Tsatsou, Stefanos Demertzis, Peter Leskovský, Carlos Mendes, Shona Linehan, John Mulcahy, Ioannis Karvelas, Manuel Álvarez Fernández, André Alegria

Proceedings of the Artificial Intelligence Applications and Innovations. AIAI 2024 IFIP WG 12.5 International Workshops, 2024

2023

Collaborative SAR Modeling and Prospective In Vitro Validation of Oxidative Stress Activation in Human HepG2 Cells.

Olivier J. M. Béquignon, Jose C. Gómez-Tamayo, Eelke B. Lenselink, Steven Wink, Steven Hiemstra, Chi Chung Lam, Domenico Gadaleta, Alessandra Roncaglioni, Ulf Norinder, Bob van de Water, Manuel Pastor, Gerard J. P. van Westen

J. Chem. Inf. Model., September, 2023

Application of machine learning to improve the efficiency of electrophysiological simulations used for the prediction of drug-induced ventricular arrhythmia.

Pablo Rodríguez-Belenguer, Karolina Kopanska, Jordi Llopis-Lorente, Beatriz Trénor, Javier Saiz, Manuel Pastor

Comput. Methods Programs Biomed., March, 2023

2021

Flame: an open source framework for model development, hosting, and usage in production environments.

Manuel Pastor, José C. Gómez-Tamayo, Ferran Sanz

J. Cheminformatics, 2021

Accelerating the timeline for climate action in California.

Daniel M. Kammen, Teenie Matlock, Manuel Pastor, David Pellow, Veerabhadran Ramanathan, Tom Steyer, Leah Stokes, Feliz Ventura

CoRR, 2021

2018

In Silico QT and APD Prolongation Assay for Early Screening of Drug-Induced Proarrhythmic Risk.

Lucía Romero, Jordi Cano, Julio Gomis-Tena, Beatriz Trénor, Ferran Sanz, Manuel Pastor, Javier Saiz

J. Chem. Inf. Model., 2018

An automated tool for obtaining QSAR-ready series of compounds using semantic web technologies.

Oriol López-Massaguer, Ferran Sanz, Manuel Pastor

Bioinform., 2018

Development and Validation of an In Silico Rabbit Purkinje Cell Action Potential Model: A Step Towards a Drug Safety Testing Tool.

Jordi Cano, Julio Gomis-Tena, Alexander Amberg, Lennart Anger, Véronique Ballet, Jean-Michel Guillon, Manuel Pastor, Ferran Sanz, Lucía Romero, Javier Saiz

Proceedings of the Computing in Cardiology, 2018

2015

eTOXlab, an open source modeling framework for implementing predictive models in production environments.

Pau Carrió, Oriol López, Ferran Sanz, Manuel Pastor

J. Cheminformatics, 2015

2014

Applicability Domain Analysis (ADAN): A Robust Method for Assessing the Reliability of Drug Property Predictions.

Pau Carrió, Marta Pinto, Gerhard F. Ecker, Ferran Sanz, Manuel Pastor

J. Chem. Inf. Model., 2014

2013

2D- and 3D-QSAR studies of a series of benzopyranes and benzopyrano[3, 4b][1, 4]-oxazines as inhibitors of the multidrug transporter P-glycoprotein.

Ishrat Jabeen, Penpun Wetwitayaklung, Peter Chiba, Manuel Pastor, Gerhard F. Ecker

J. Comput. Aided Mol. Des., 2013

2011

A Multiscale Simulation System for the Prediction of Drug-Induced Cardiotoxicity.

Cristian Obiol-Pardo, Julio Gomis-Tena, Ferran Sanz, Javier Saiz, Manuel Pastor

J. Chem. Inf. Model., 2011

2010

Induced Effects of Sodium Ions on Dopaminergic G-Protein Coupled Receptors.

Jana Selent, Ferran Sanz, Manuel Pastor, Gianni De Fabritiis

PLoS Comput. Biol., 2010

2009

Suitability of GRIND-Based Principal Properties for the Description of Molecular Similarity and Ligand-Based Virtual Screening.

Ángel Durán, Ismael Zamora, Manuel Pastor

J. Chem. Inf. Model., 2009

2008

Development and Validation of AMANDA, a New Algorithm for Selecting Highly Relevant Regions in Molecular Interaction Fields.

Albert Duran, Guillermo C. Martínez, Manuel Pastor

J. Chem. Inf. Model., 2008

2002

Distant collaboration in drug discovery: The LINK3D project.

Manuel Pastor, Paolo Benedetti, Angelo Carotti, Antonio Carrieri, Carlos Díaz, Cristina Herráiz, Hans-Dieter Höltje, Maria Isabel Loza, Tudor I. Oprea, Fernando Padín, Francesc Pubill, Ferran Sanz, Friederike Stoll

J. Comput. Aided Mol. Des., 2002

2000

3D-QSAR methods on the basis of ligand-receptor complexes. Application of COMBINE and GRID/GOLPE methodologies to a series of CYP1A2 ligands.

Juan José Lozano, Manuel Pastor, Gabriele Cruciani, Katrin Gaedt, Nuria B. Centeno, Federico Gago, Ferran Sanz

J. Comput. Aided Mol. Des., 2000

1994

New Developments of EDISFAR Programs. Experimental Design in QSAR Practice.

Manuel Pastor, Julio Alvarez-Builla

J. Chem. Inf. Comput. Sci., 1994