Mario Fernández-Pendás

According to our database, Mario Fernández-Pendás authored at least 5 papers between 2016 and 2024.

Collaborative distances:

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

2024

Adaptive multi-stage integration schemes for Hamiltonian Monte Carlo.

Lorenzo Nagar, Mario Fernández-Pendás, Jesús María Sanz-Serna, Elena V. Akhmatskaya

J. Comput. Phys., 2024

2022

AMBER Drug Discovery Boost Tools: Automated Workflow for Production Free-Energy Simulation Setup and Analysis (ProFESSA).

Abir Ganguly, Hsu-Chun Tsai, Mario Fernández-Pendás, Tai-Sung Lee, Timothy J. Giese, Darrin M. York

J. Chem. Inf. Model., 2022

A study of the performance of classical minimizers in the Quantum Approximate Optimization Algorithm.

Mario Fernández-Pendás, Elías F. Combarro, Sofia Vallecorsa, José Ranilla, Ignacio F. Rúa

J. Comput. Appl. Math., 2022

2018

Multi-stage splitting integrators for sampling with modified Hamiltonian Monte Carlo methods.

Tijana Radivojevic, Mario Fernández-Pendás, Jesús María Sanz-Serna, Elena V. Akhmatskaya

J. Comput. Phys., 2018

2016

Adaptive multi-stage integrators for optimal energy conservation in molecular simulations.

Mario Fernández-Pendás, Elena V. Akhmatskaya, Jesús María Sanz-Serna

J. Comput. Phys., 2016