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OpenFermion: the electronic structure package for quantum computers2020 Quantum Science and Technology article Computer Science Quantum Computing Algorithms and Architecture Open access
Jarrod R. McClean, Nicholas C. Rubin, Kevin J. Sung, Ian Kivlichan, Xavier Bonet-Monroig, Yudong Cao, +28 more
466citations -
GraspOS Deliverable D3.3: Tools and services2025 Zenodo (CERN European Organization for Nuclear Research) article Computer Science Distributed and Parallel Computing Systems Open access
Thanasis Vergoulis, Serafeim Chatzopoulos, Giulia Malaguarnera, Zacharoula Xenou, Leonidas Pispiringas, Harry Dimitropoulos, +13 more
0citations -
AiZynthFinder 4.0: developments based on learnings from 3 years of industrial application2024 Journal of Cheminformatics article Computer Science Computational Drug Discovery Methods Open access
Lakshidaa Saigiridharan, Alan Kai Hassen, Helen Lai, Paula Torren-Peraire, Ola Engkvist, Samuel Genheden
55citations -
DrugEx: Deep Learning Models and Tools for Exploration of Drug-Like Chemical Space2023 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Martin Šícho, Sohvi Luukkonen, Helle W. van den Maagdenberg, Linde Schoenmaker, Olivier J. M. Béquignon, Gerard J. P. van Westen
40citations -
Bridging Data Standards and FAIR Principles in Biodiversity Digital Twinning: Prototyping, Challenges, Lessons Learned, and Future Plans2024 Biodiversity Information Science and Standards article Computer Science Research Data Management Practices Open access
Sharif Islam, Julian Lopez Gordillo, Dag Endresen, Carrie J. Andrew
2citations -
Model-driven engineering for mobile robotic systems: a systematic mapping study2021 Software & Systems Modeling article Computer Science Model-Driven Software Engineering Techniques Open access
Giuseppina Lucia Casalaro, Giulio Cattivera, Federico Ciccozzi, Ivano Malavolta, Andreas Wortmann, Patrizio Pelliccione
45citations -
Camtrap DP: an open standard for the FAIR exchange and archiving of camera trap data2023 Remote Sensing in Ecology and Conservation article Computer Science Research Data Management Practices Open access
Jakub W. Bubnicki, Ben Norton, Steve Baskauf, Tom Bruce, Francesca Cagnacci, Jim Casaer, +30 more
31citations -
Data Standards and Interoperability Challenges for Biodiversity Digital Twin: A novel and transformative approach to biodiversity research and application2023 Biodiversity Information Science and Standards article Computer Science Research Data Management Practices Open access
Sharif Islam, Hanna Koivula, Dag Endresen, Erik Kusch, Dmitry Schigel, Wouter Addink
1citations -
AlphaFold Meets De Novo Drug Design: Leveraging Structural Protein Information in Multitarget Molecular Generative Models2024 Journal of Chemical Information and Modeling article Computer Science Computational Drug Discovery Methods Open access
Andrius Bernatavicius, Martin Šícho, Antonius P. A. Janssen, Alan Kai Hassen, Mike Preuß, Gerard J. P. van Westen
20citations