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Papers matching “metallicity” 11

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When AI Bends Metal: AI-Assisted Optimization of Design Parameters in Sheet Metal Forming
2025 arXiv (Cornell University) preprint Computer Science Advanced Multi-Objective Optimization Algorithms Open access

Ahmad Tarraf, Koutaiba El Rifai Kassem-Manthey, Philipp Martin, Lukas Moj, Semih Burak, Christian Terboven, +1 more

1

citations
MetalDock: an open access docking tool for easy and reproducible docking of metal complexes
2023 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Matthijs L. A. Hakkennes, Francesco Buda, Sylvestre A. Bonnet

1

citations
Transfer learning for predicting protein binding affinities of metal-organic inhibitors
2026 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Matthijs L. A. Hakkennes, Wojtek Treyde, Francesco Buda, Sylvestre A. Bonnet, Fernanda Duarte

0

citations
A Stereochemistry-Aware Circular Algorithm and Fingerprint for Resonance-Invariant Molecular Representation
2026 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Maxim Papusha, Kai O. Leonhard

0

citations
Circular Stereo Algorithm and Fingerprint for Chiral Resonance Invariant Molecular Representation
2026 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Maxim Papusha, Kai O. Leonhard

0

citations
Modeling Dislocation Dynamics Data Using Semantic Web Technologies
2023 arXiv (Cornell University) preprint Computer Science Semantic Web and Ontologies Open access

Ahmad Zainul Ihsan, Said Fathalla, Stefan Sandfeld

0

citations
MULTIMAP TARGETED FREE ENERGY ESTIMATION: A MECHANICAL EMBEDDING QM/MM SCHEME FOR PROTEIN-LIGAND AFFINITIES
2026 ChemRxiv preprint Computer Science Computational Drug Discovery Methods Open access

Jacques Gay, Andrea Rizzi, Shina Caroline Lynn Kamerlin, Davide Mandelli, Paolo Carloni

0

citations
DISO: A Domain Ontology for Modeling Dislocations in Crystalline Materials
2024 arXiv (Cornell University) preprint Computer Science Semantic Web and Ontologies Open access

Ahmad Zainul Ihsan, Said Fathalla, Stefan Sandfeld

0

citations
Robust Environment Perception for Automated Driving: A Unified Learning Pipeline for Visual-Infrared Object Detection
2022 arXiv (Cornell University) preprint Computer Science Advanced Neural Network Applications Open access

Mohsen Vadidar, Ali Kariminezhad, Christian Mayr, Laurent Kloeker, Lutz Eckstein

0

citations
DATA-DRIVEN CAUSAL DISCOVERY IN CATALYSIS
2026 ChemRxiv preprint Computer Science Bayesian Modeling and Causal Inference Open access

Bárbara Alves Sequeira, Adèle H. Ribeiro, Catarina Barata, Carmen Bacariza, Pedro S. F. Mendes

0

citations
Beyond Benchmarks: Towards Robust Artificial Intelligence Bone Segmentation in Socio-Technical Systems
2025 medRxiv preprint Computer Science Medical Image Segmentation Techniques Open access

Kunpeng Xie, Lennart Johannes Gruber, Martin Crampen, Yao Li, André Filipe Ferreira, Elias Tappeiner, +43 more

0

citations

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