P. Sandås, S. Iserte, I. Aréjula-Aísa, B. Hess, and A. Peña, "Malleable Molecular Dynamics Simulations with GROMACS and DMR." 16th Parallel Processing and Applied Mathematics (PPAM), Sep. 2026.
M. Cipollini, S. Rizzo, S. Iserte, P. Viviani, G. Vitali, M. Barbieri, G. Bettonte, E. Boella, F. Ganz, R. Rocco, O. Spina, A. Peña, P. Sandås, I. Colonnelli, A. Scionti, C. Vercellino, E. Dri, J. Frassineti, S. Marzella, A. Muratori, D. Ottaviani, O. Terzo, B. Montrucchio, and D. Gregori, "Three ways to share a QPU: Scheduling strategies for hybrid Quantum-HPC applications." Future Generation Computer Systems(185), pp. 108699, Jan. 2026. ISSN: 0167-739X.
S. Iserte, I. Martín-Álvarez, K. Rojek, J. Aliaga, M. Castillo, W. Folwarska, and A. Peña, "Resource optimization with MPI process malleability for dynamic workloads in HPC clusters." Future Generation Computer Systems, pp. 107949, Jan. 2026. ISSN: 0167-739X.
W. Folwarska, K. Rojek, K. Halbiniak, and S. Iserte, "Performance and Scalability Analysis of a MoE Model for MPDATA on Multi-GPU HPC System." Computational Science -- ICCS 2026 Workshops, pp. 101--115, Jan. 2026.
S. Ljaljevic, J. Jorba, and S. Iserte, "Exploring the role of Large Language Models in High-Performance Computing programming: A survey." Future Generation Computer Systems, pp. 108618, Jan. 2026. ISSN: 0167-739X.
M. Palkowski, S. Iserte, T. Olas, M. Gruzewski, and R. Wyrzykowski, "A Parallel and Vectorized Implementation of the McCaskill Algorithm for X86-64 and RISC-V Architectures." Computational Science -- ICCS 2026 Workshops, pp. 588--603, Jan. 2026.
S. Iserte, M. Madon, G. Da, J. Pierson, and A. Peña, "MPI Malleability Validation under Replayed Real-World HPC Conditions." Future Generation Computer Systems, pp. 108305, Dec. 2025. ISSN: 0167-739X.
D. Huber, K. Gaddameedi, T. Neckel, H. Bungartz, M. Schulz, P. Dutot, O. Richard, M. Schreiber, S. Iserte, and A. Pena, "Dynamic Resource Management in HPC Systems Using Dynamic Processes with PSets." 2025 IEEE 32nd International Conference on High Performance Computing, Data, and Analytics (HiPC), pp. 279--289, Dec. 2025.
M. Usman, M. Benito, S. Iserte, and A. Peña, "ODOS-MPI: HPC-Friendly SmartNIC Offloading of Computation/Communication Kernels." Proceedings of the International Conference for High Performance Computing, Networking, Storage and Analysis, pp. 1006--1027, Nov. 2025.
S. Iserte, G. Houzeaux, P. Sandås, A. Peña, and M. Garcia-Gasulla, "Malleable Computational Fluid Dynamics Simulations." Proceedings of the 36th Parallel CFD International Conference, Nov. 2025.
A. González, S. Iserte, M. Castillo, J. Luis-Gómez, R. Martínez-Cuenca, G. Monrós-Andreu, and S. Chiva, "Machine Learning-Based Forecasting of Wastewater Inflow During Rain Events at a Spanish Mediterranean Coastal WWTPs." Water, Nov. 2025. ISSN: 2073-4441.
R. Rocco, S. Rizzo, M. Barbieri, G. Bettonte, E. Boella, F. Ganz, S. Iserte, A. Peña, P. Sandås, A. Scionti, O. Terzo, C. Vercellino, G. Vitali, P. Viviani, J. Frassineti, S. Marzella, D. Ottaviani, I. Colonnelli, and D. Gregori, "Dynamic Solutions for Hybrid Quantum-HPC Resource Allocation." 2025 IEEE International Conference on Quantum Computing and Engineering (QCE)(02), pp. 34--40, Aug. 2025.
A. Kamiński, M. Wybraniak-Kujawa, S. Iserte, and J. Krawiec, "The Use of Artificial Intelligence and Virtual Computer Laboratories to Develop Computer Science Education." Computational Science – ICCS 2025 Workshops, Jul. 2025.
D. Huber, S. Iserte, M. Schreiber, A. Peña, and M. Schulz, "Bridging the Gap Between Genericity and Programmability of Dynamic Resources in HPC." ISC High Performance 2025 Research Paper Proceedings (40th International Conference), pp. 1--11, Jun. 2025.
S. Iserte, I. Martín-Álvarez, K. Rojek, J. Aliaga, M. Castillo, and A. Peña, "Towards the Democratization and Standardization of Dynamic Resources with MPI Spawning." 15th Parallel Processing and Applied Mathematics (PPAM), pp. 287--300, Sep. 2024.
S. Iserte, V. Lopez, M. Garcia-Gasulla, and A. Peña, "Parallel Efficiency-aware Standard MPI-based Malleability." Euro-Par Workshops Proceedings, Aug. 2024.
I. Martín-Álvarez, J. Aliaga, M. Castillo, and S. Iserte, "Proteo: a framework for the generation and evaluation of malleable MPI applications." The Journal of Supercomputing, Jul. 2024. ISSN: 1573-0484.
A. Tarraf, M. Schreiber, A. Cascajo, J. Besnard, M. Vef, D. Huber, S. Happ, A. Brinkmann, D. Singh, H. Hoppe, A. Miranda, A. Peña, R. Machado, M. Gasulla, M. Schulz, P. Carpenter, S. Pickartz, T. Rotaru, S. Iserte, V. Lopez, J. Ejarque, H. Sirwani, and F. Wolf, "Malleability in Modern HPC Systems: Current Experiences, Challenges, and Future Opportunities." IEEE Transactions on Parallel and Distributed Systems, pp. 1--14, Jun. 2024. ISSN: 1558-2183.
P. Dutot, J. Fecht, K. Gaddameedi, D. Huber, S. Iserte, M. Minion, M. Schulz, M. Schreiber, V. Schüller, A. Peña, and O. Richard, "Leveraging Dynamic Resource Management in HPC." ISC, Jun. 2024.
S. Iserte, M. Morales-Hernández, J. Segovia, P. Vallés, D. Caviedes-Voullième, and A. Peña, "Dynamic Resources Utilization in Malleable Flooding Simulations." 16th JLESC, Apr. 2024.
K. Halbiniak, K. Rojek, S. Iserte, and R. Wyrzykowski, "Unleashing the Potential of Mixed Precision in AI-Accelerated CFD Simulation on Intel CPU/GPU Architectures." Computational Science – ICCS 2024, pp. 203--217, Mar. 2024.
I. Martín, M. Castillo, J. Aliaga, and S. Iserte, "Efficient Data Redistribution for Malleable Applications." ExaMPI23 held in conjunction with SC, Nov. 2023.
M. Usman, S. Iserte, R. Ferrer, and A. Peña, "DPU Offloading Programming with the OpenMP API." LLVM-HPC23 held in conjunction with SC, Nov. 2023.
M. Usman, S. Iserte, R. Ferrer, and A. Peña, "BlueField DPU Programming using OpenMP Offloading." IEEE CLUSTER, Nov. 2023.
R. Martínez-Cuenca, J. Luis-Gómez, S. Iserte, and S. Chiva, "On the Use of Deep Learning and Computational Fluid Dynamics for the Estimation of Uniform Momentum Source Components of Propellers." iScience(26), pp. 1--14, Oct. 2023.
S. Iserte, V. Lopez, M. Garcia-Gasulla, and A. Peña, "Maleabilidad MPI basada en la eficiencia paralela." XXXIII Jornadas SARTECO, Sep. 2023.
A. González-Barberá, P. Barreda, K. Rojek, and S. Iserte, "Estudio del rendimiento en entrenamientos distribuidos para simulaciones CFD data-driven." XXXIII Jornadas SARTECO, Sep. 2023.
I. Martín-Álvarez, J. Aliaga, M. Castillo, and S. Iserte, "Análisis de métodos de redistribución de datos para aplicaciones MPI maleables." XXXIII Jornadas SARTECO, Sep. 2023.
P. Rosciszewski, A. Krzywaniak, S. Iserte, K. Rojek, and P. Gepner, "Optimizing Throughput of Seq2Seq Model Training on the IPU Platform for AI-accelerated CFD Simulations." Future Generation Computer Systems(143), pp. 149--162, May 2023.
I. Martín-Álvarez, J. Aliaga, M. Castillo, S. Iserte, and R. Mayo, "Dynamic spawning of MPI processes applied to malleability." International Journal of High Performance Computing Applications(0), pp. 1--25, May 2023.
S. Iserte, A. González-Barberá, P. Barreda, and K. Rojek, "A Study on the Performance of Distributed Training of Data-driven CFD Simulations." International Journal of High Performance Computing Applications(37), pp. 503--515, May 2023. ISSN: 1094-3420.
I. Martín-Álvarez, J. Aliaga, M. Castillo, and S. Iserte, "Configurable Synthetic Application for Studying Malleability in HPC." 31st Euromicro International Conference on Parallel, Distributed, and Network-Based Processing (PDP), Mar. 2023.
S. Iserte, V. Tomas, M. Pérez, M. Castillo, P. Boronat, and L. Amable, "Complete Integration of Team Project-based Learning into a Database Syllabus." IEEE Transactions on Education(3), pp. 1--8, Nov. 2022. ISSN: 0018-9359.
I. Martín-Álvarez, J. Aliaga, M. Castillo, S. Iserte, and R. Mayo, "Aplicación sintética para el estudio de maleabilidad en computación de altas prestaciones." XXXII Jornadas SARTECO, Sep. 2022.
P. Rosciszewski, A. Krzywaniak, S. Iserte, K. Rojek, and P. Gepner, "Adaptation of AI-accelerated CFD Simulations to the IPU platform." 1st Workshop on Applications of Machine Learning and Artificial Intelligence in High-Performance Computing (WAML-HPC) held in conjunction with PPAM, Sep. 2022.
S. Iserte, A. Macías, R. Martínez-Cuenca, S. Chiva, R. Paredes, and E. Quintana-Ortí, "Accelerating Urban Scale Simulations Leveraging Local Spatial 3D Structure." Journal of Computational Science(62), pp. 1--11, Jul. 2022. ISSN: 1877-7503.
J. Aliaga, M. Castillo, S. Iserte, I. Martín-Álvarez, and R. Mayo, "A Survey on Malleability Solutions for High-Performance Distributed Computing." Applied Science(12), pp. 1--32, May 2022. ISSN: 2076-3417.
S. Iserte, "A Study on the Resource Utilization and User Behavior on Titan Supercomputer." Driving Scientific and Engineering Discoveries Through the Integration of Experiment, Big Data, and Modeling and Simulation(1512), pp. 1-8, Mar. 2022.
S. Iserte, P. Carratalà, R. Arnau, R. Martínez-Cuenca, P. Barreda, L. Basiero, J. Climent, and S. Chiva, "Modeling of Wastewater Treatment Processes with HydroSludge." Water Environment Research(93), pp. 3049--3063, Oct. 2021. ISSN: 1061-4303.
S. Catalán, R. Carratalá-Sáez, and S. Iserte, "Leveraging Teaching on Demand: Approaching HPC to Undergrads." Journal of Parallel and Distributed Computing(156), pp. 148--162, Oct. 2021. ISSN: 0743-7315.
V. Tomás, M. Castillo, M. Pérez, P. Boronat, L. Amable, and S. Iserte, "Improving Basic Competences Through Project-based Learning and Teamworking." VI Congreso Internacional sobre Aprendizaje, Innovación y Cooperación (CINAIC), Oct. 2021.
I. Martín, J. Aliaga, M. Castillo, R. Mayo, and S. Iserte, "Malleability Implementation in a MPI Iterative Method." IEEE CLUSTER, Sep. 2021. ISSN: 978-1-7281-9666-4.
F. Majó, P. Barreda, and S. Iserte, "A Distributed Mesh Generation Study Case through a Customizable Platform as a Service Framework." 11th International Conference on Simulation and Modeling Methodologies, Technologies and Applications (SIMULTECH), Jul. 2021.
S. Iserte, S. Catalán, R. Carratalá-Saez, and S. López, "Construya su propio supercomputador con Raspberri Pi." Construya su propio supercomputador con Raspberri Pi, May 2021.
V. Tomás, S. Iserte, and M. Pérez, "Learning Databases Using Project-based Learning." 15th International Technology, Education and Development Conference (INTED), Mar. 2021.
S. Iserte, and K. Rojek, "A Study of the Effect of Process Malleability in the Energy Efficiency on GPU-based Clusters." Journal of Supercomputing(76), pp. 255--274, Oct. 2020. ISSN: 0920-8542.
S. Iserte, R. Mayo, E. Quintana-Ortí, and A. Peña, "DMRlib: Easy-coding and Efficient Resource Management for Job Malleability." IEEE Transactions on Computers(70), pp. 1443--1457, Sep. 2020. ISSN: 0018-9340.
R. Carratalá, S. Iserte, and S. Catalán, "Teaching on Demand: an HPC Experience." Workshop on Education for High Performance Computing (EduHPC) held in conjunction with SC, Nov. 2019.
J. Agustina, R. Cuenca, J. Vilarroig, R. Arnau, L. Basiero, R. Tirado, S. Iserte, and S. Chiva, "Desarrollo de una herramienta de simulación computacional 3D aplicada a procesos de depuración de aguas residuales." VI Jornadas de Ingeniería del Agua, Oct. 2019.
F. Silla, S. Iserte, C. Reaño, and J. Prades, "Improving the Management Efficiency of GPU Workloads in Data Centers through GPU Virtualization." Concurrency and Computation: Practice and Experience(33), pp. 1--10, Apr. 2019. ISSN: 1532-0626.
S. Iserte, A. Peña, and R. Mayo, "Boosting Productivity through Efficient Resource Management." ACM/IFIP International Middleware Conference, Doctoral Symposium, Dec. 2018.
S. Iserte, A. Peña, and R. Mayo, "Productivity-enhancing malleability for HPC applications." 27th International Conference on Parallel Architectures and Compilation Techniques (PACT18), ACM Student Research Competition (SRC), Nov. 2018.
S. Iserte, H. Martínez, S. Barrachina, M. Castillo, R. Mayo, E. Quintana-Ortí, and A. Peña, "MPI Malleability Integration into a Bioinformatics Tool." Euro/USA MPI Conference, Sep. 2018.
S. Iserte, H. Martínez, S. Barrachina, M. Castillo, R. Mayo, and A. Peña, "Dynamic Reconfiguration of Non-iterative Scientific Applications: A Case Study with HPG-aligner." International Journal of High Performance Computing Application(33), pp. 1--10, Aug. 2018. ISSN: 1094-3420.
S. Iserte, R. Mayo, E. Quintana-Ortí, and A. Peña, "High-throughput Computation through MPI Malleability." Advanced Computer Architecture and Compilation for High-Performance and Embedded Systems (ACACES), Jul. 2018. ISSN: 978-88-905806-6-6.
S. Iserte, R. Peña-Ortíz, J. Gutiérrez-Aguado, J. Claver, and R. Mayo, "GSaaS: A Service to Cloudify and Schedule GPUs." IEEE Access(6), pp. 39762--39774, Jul. 2018. ISSN: 2169-3536.
S. Iserte, R. Mayo, E. Quintana-Ortí, V. Beltran, and A. Peña, "DMR API: Improving Cluster Productivity by Turning Applications into Malleable." Parallel Computing(78), pp. 54--66, Jul. 2018. ISSN: 0167-8191.
A. Castelló, S. Iserte, and A. Belloch, "Accessible C-programming course from scratch using a MOOC platform without limitations." 4th International Conference on Higher Education Advances (HEAD), Jun. 2018.
S. Iserte, R. Mayo, E. Quintana-Ortí, V. Beltran, and A. Peña, "El camino desde la maleabilidad MPI hasta las cargas de trabajos adapativas." XXVIII Jornadas SARTECO, Sep. 2017.
S. Iserte, R. Mayo, E. Quintana-Ortí, V. Beltran, and A. Peña, "Efficient Scalable Computing through Flexible Applications and Adaptive Workloads." 10th International Workshop on Parallel Programming Models and Systems Software for High-End Computing (P2S2) held in conjunction with IPDPS, Aug. 2017.
F. Silla, S. Iserte, C. Reaño, and J. Prades, "On the Benefits of the Remote GPU Virtualization Mechanism: the rCUDA Case." Concurrency and Computation: Practice and Experience(29), pp. 1--10, Feb. 2017. ISSN: 1532-0634.
S. Iserte, J. Prades, C. Reaño, and F. Silla, "Increasing the Performance of Data Centers by Combining Remote GPU Virtualization with Slurm." 16th IEEE/ACM International Symposium on Cluster, Cloud and Grid Computing (CCGrid), May 2016.
S. Iserte, F. Clemente-Castelló, A. Castelló, R. Mayo, and E. Quintana-Ortí, "Enabling GPU Virtualization in Cloud Environments." 6th International Conference on Cloud Computing and Services Science (CLOSER), Apr. 2016.
F. Silla, C. Reaño, J. Prades, and S. Iserte, "Benefits of remote GPU virtualization: the rCUDA perspective." GPU Technology Conference (GTC), Apr. 2016.
F. Silla, J. Prades, S. Iserte, and C. Reaño, "Remote GPU Virtualization: Is It Useful?." 2nd IEEE International Workshop on High-Performance Interconnection Networks in the Exascale and Big-Data Era (HiPINEB), Mar. 2016.
S. Iserte, A. Peña, R. Mayo, E. Quintana-Ortí, and V. Beltran, "Dynamic Management of Resource Allocation for OmpSs Jobs." 1st PhD Symposium on Sustainable Ultrascale Computing Systems (NESUS PhD), Feb. 2016.
S. Iserte, A. Castelló, R. Mayo, E. Quintana-Ortí, J. Prades, C. Reaño, F. Silla, and J. Duato, "Comparativa de políticas de selección de GPUs remotas en clusters HPC." XXVI Jornadas SARTECO, Sep. 2015.
S. Iserte, F. Clemente, R. Mayo, and E. Quintana-Ortí, "GPU Virtualization in the Cloud." Advanced Computer Architecture and Compilation for High-Performance and Embedded Systems (ACACES), Jul. 2015. ISSN: 978-88-905806-3-5.
S. Iserte, A. Castelló, R. Mayo, E. Quintana-Ortí, C. Reaño, J. Prades, F. Silla, and J. Duato, "Slurm Support for Remote GPU Virtualization: Implementation and Performance Study." 26th Symposium on Computer Architecture and High Performance Computing (SBAC-PAD), Oct. 2014.
S. Iserte, A. Castelló, R. Mayo, E. Quintana-Ortí, J. Prades, C. Reaño, F. Silla, and J. Duato, "Extendiendo SLURM con soporte para el uso de GPUs remotas." XXV Jornadas SARTECO, Sep. 2014.
C. Reaño, A. Castelló, S. Iserte, A. Peña, F. Silla, R. Mayo, E. Quintana-Ortí, and J. Duato, "Virtualización remota de GPUs: Evaluación de soluciones disponibles para CUDA." XXIV Jornadas SARTECO, Sep. 2013.
S. Iserte, A. Castelló, C. Reaño, A. Peña, F. Silla, R. Mayo, E. Quintana-Ortí, and J. Duato, "Un planificador de GPUs remotas para clusters HPC." XXIV Jornadas SARTECO, Sep. 2013.
M. Dolz, J. Fernández, S. Iserte, R. Mayo, and E. Quintana, "A Simulator to Assess Energy Saving Strategies and Policies in HPC Workloads." ACM Operating Systems Review(49), pp. 2--9, Jul. 2012. ISSN: 0163-5980.
M. Dolz, J. Fernández, S. Iserte, R. Mayo, and E. Quintana, "A Flexible Simulator to Evaluate a Power Saving System for HPC Clusters." 2nd International Workshop on Green Computing Middleware (GCM), Dec. 2011.
M. Dolz, J. Fernández, S. Iserte, R. Mayo, E. Quintana, M. Cotallo, and G. Díaz, "EnergySaving Cluster Experience in CETA-CIEMAT." 5th Iberian Grid Infrastructure Conference (IBERGRID), Jun. 2011.
seminar at Severo Ochoa Research Seminars @ BSC, Barcelona (Spain)
seminar at Fifth workshop on Communication, I/O, and Storage at Scale on Next-Generation Platforms - Scalable Infrastructures, Hamburg (Germany)
seminar at Academic Salon on High-Performance Ethernet: Host Networking and Monitoring, Munich (Germany)
seminar at Invited by prof.dr hab.inż. Roman Wyrzykowski, Częstochowska (Poland)
conference at 15th International Conference on Parallel Processing & Applied Mathematics (PPAM), Ostrava (Czech Republic)
workshop at 3rd Workshop on Dynamic Resource Management in HPC (DynResHPC), Madrid (Spain)
seminar at Tutorial at 31st IEEE Hot Interconnects Symposium, Online
seminar at System Software for Converged HPC Systems focus session at ISC24, Hamburg (Germany)
workshop at 16th JLESC Workshop, Kobe (Japan)
workshop at ExaMPI23, Denver (CO, USA)
workshop at LLVM-HPC23, Denver (USA, CO)
national at XXXIII Jornadas SARTECO (JS 2023), Ciudad Real (Spain)
seminar at RISC-V Summit Europe, Barcelona (Spain)
seminar at Severo Ochoa Research Seminars @ BSC, Barcelona (Spain)
workshop at 15th JLESC Workshop, Bordeaux (France)
seminar at Invited by prof.dr hab.inż. Roman Wyrzykowski, Częstochowska (Poland)
workshop at 5th Annual Smoky Mountains Computational Sciences Data Challenge (SMCDC21), Online
seminar at High Performance Container Workshop (VHPC) - Frankfurt, Germany, Online
workshop at 2018 ACM/IFIP International Middleware Conference, Doctoral Symposium, Rennes (France)
workshop at ACM Student Research Competition -- PACT18, Limassol (Cyprus)
workshop at Your PhD Thesis in 3 Minutes Competition IV -- XXIX Jornadas SARTECO, Teruel (Spain)
national at XXVIII Jornadas SARTECO (JS 2017), Málaga (Spain)
workshop at 10th Workshop on Parallel Programming Models and Systems Software for High-End Computing (P2S2 2017), Bristol (United Kingdom)
conference at 6th International Conference on Cloud Computing and Services Science (CLOSER), Rome (Italy)
workshop at 1st Training School of COST Action IC1305 -- Nesus Winter School & PhD Symposium, Timisoara (Romania)
national at XXVI Jornadas SARTECO 2015, Córdoba (Spain)
seminar at Amazon AWS Day, Universitat Jaume I, Castelló de la Plana (Spain)
conference at 26th Symposium on Computer Architecture and High-Performance Computing (SBAC-PAD), Paris (France)
seminar at Slurm User Group Meeting 2014, Lugano (Switzerland)
national at XXV Jornadas SARTECO 2014, Valladolid (Spain)
national at XXIV Jornadas SARTECO 2013, Madrid (Spain)