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distance geometry

7 papers

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Co-occurring keywords · papers mentioning both

molecular generation (2) mixture of linear regression (1) molecular conformation generation (1) 3d molecular generation (1) molecular conformation (1) diffusion-based generative model (1) geometric diffusion (1) pretraining phase (1) out-of-distribution molecule (1) transmission matrix (1)

Papers

Enhancing Generalizability in Molecular Conformation Generation with METRIZATION-Informed Geometric Diffusion Pretraining AAAI 2025 Structure-Aware E(3)-Invariant Molecular Conformer Aggregation Networks ICML 2024 Sharp analysis of EM for learning mixtures of pairwise differences COLT 2023 An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming ICML 2021 A Generative Model for Molecular Distance Geometry ICML 2020 Don't take it lightly: Phasing optical random projections with unknown operators NeurIPS 2019 Uniqueness of Ordinal Embedding COLT 2014