Typed states for the displayed outbound observations.
Source: paper_references, paper_reference_links, observed 2026-08-05T14:25:31.339421Z
Paper Citation Record · LEDGER
As of 7 August 2026, this Paper Citation Record lists 57 of 57 outbound references and 1 inbound Pith citation observation for arXiv:2508.21468.
A citation records a reference. It does not transfer a finding from one paper to another.
Typed states for the displayed outbound observations.
Source: paper_references, paper_reference_links, observed 2026-08-05T14:25:31.339421Z
One-hop event checks from named stored sources.
Source: scholarly_work_events, retraction_status_cache, observed 2026-08-07T06:34:17.273281+00:00
Pith citing papers itemized under the disclosed page cap.
Source: paper_references, paper_reference_links, observed 2026-06-28T15:56:09.312666Z
A source-named dated measurement, never combined with another source.
Source: arxiv_reference, observed 2026-07-01T21:56:16.227901Z
57 of 57 outbound references displayed
External citation measurements
No source-named external measurement is stored.
Observation a3d9517c-6948-408d-8383-7af5eb2e1754 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Accurate structure prediction of biomolecular interactions with alphafold 3
Reference 1
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 4bacf021-a84d-40a9-9ea6-43e7e510f6ef · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Protein sequence modelling with bayesian flow networks
Reference 2
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 3c3e4d77-9c29-4f60-b393-0b2981d5b957 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Geometric deep learning methods and applications in 3d structure-based drug design
Reference 3
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 318f2416-f1ab-4dc7-a27b-fe65ae3fcb43 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Equivariant Energy-Guided SDE for Inverse Molecular Design
Reference 4
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation b6f900e0-c1be-483d-9404-e370738b467c · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Posebusters: Ai-based docking methods fail to generate physically valid poses or generalise to novel sequences
Reference 5
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 98ef91fa-49af-4542-ba35-b0d28b6a0347 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Pid- iff: Physics informed diffusion model for protein pocket-specific 3d molecular generation
Reference 6
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 179abc6c-775e-479d-be29-aaa145361f06 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Diffusion posterior sampling for general noisy inverse problems
Reference 7
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation af2d385f-5358-4730-b16c-36437d9eadde · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Uniprot: a worldwide hub of protein knowledge
Reference 8
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation c0fac689-af22-4d48-a0e8-9f515df84aca · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Multi-parameter optimization: identifying high quality compounds with a balance of properties
Reference 9
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 0e59f98b-a02c-401a-a85e-691f2e72b2bf · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Comprehensive analysis of kinase inhibitor selectivity
Reference 10
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation c7ffd768-1954-40ef-875c-57ba0bdf8751 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Diffusion models beat gans on image synthesis
Reference 11
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 3ab3b6be-f575-469d-9570-4c93c09096df · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Autodock vina 1.2
Reference 12
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 3de22a8b-2936-4993-9244-d8ede7f5e13b · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Tweedie’s formula and selection bias
Reference 13
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation c622c464-ec52-495b-8f13-9ebf3428af75 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions
Reference 14
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation bff8ed79-5779-4a2b-ae68-5aabff2e0276 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Three-dimensional convolutional neural networks and a cross- docked data set for structure-based drug design
Reference 15
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 4c77817e-4aab-46b8-a2e1-7ca8182d21d2 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Reinforced genetic algorithm for structure-based drug design
Reference 16
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 46b43fad-9298-4ff8-82d9-b140a20dca0f · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Rethinking Specificity in SBDD: Leveraging Delta Score and Energy-Guided Diffusion
Reference 17
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 5ca183c5-1d0b-49a6-9a86-257db7286feb · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Bayesian Flow Networks
Reference 18
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 7e09d8f5-750d-4f95-8920-39a1015a8a24 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Aligning target-aware molecule diffusion models with exact energy optimization
Reference 19
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation a3d6ecd8-53b9-496b-b6e8-8a0fdb310be9 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration 3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction
Reference 20
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 9feb90b4-d6d5-4e3b-bcb0-1fcb0e07f3b5 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration DecompDiff: Diffusion Models with Decomposed Priors for Structure-Based Drug Design
Reference 21
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation a5feea8d-7175-412c-8958-6aea03dbb2fa · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Gradient Guidance for Diffusion Models: An Optimization Perspective
Reference 22
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 2060369a-838e-4dec-addc-4ecf849b793b · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Training- free multi-objective diffusion model for 3d molecule generation
Reference 23
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation a9931f27-b7e7-4b53-a45f-e4ee13bdd8e7 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Posecheck: Generative models for 3d structure-based drug design produce unrealistic poses
Reference 24
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 5057ed33-0ed7-42bc-8f74-c7608534345a · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Protein-ligand interaction prior for binding- aware 3d molecule diffusion models
Reference 25
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation f95ea69a-eb56-4cd1-9aad-f8871d8cf413 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Rational approaches to improving selectivity in drug design
Reference 26
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation dfb58398-b767-4cc3-b3ca-7dd20043e546 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration A quantitative analysis of kinase inhibitor selectivity
Reference 27
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 417424e6-728b-4418-a579-dab5d851a69b · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Noise2score: tweedie’s approach to self-supervised image denoising without clean images
Reference 28
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation aedf26a6-bb0f-469d-9893-d5dd626fa00b · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Recent developments in structure-based drug design
Reference 29
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 80d40693-b026-462e-84f1-9895cea71a9e · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Lessons learned in empirical scoring with smina from the csar 2011 benchmarking exercise
Reference 30
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 78adbec1-0a09-401d-832d-bd35e2329254 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration A 3d generative model for structure-based drug design
Reference 31
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 76804ed2-7673-4633-aa5f-1b54f711b2a4 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Gnina 1.0: molecular docking with deep learning
Reference 32
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation b03e1972-15a5-48d2-992e-ec8d8ccbcd94 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration 3d molecule generation by denoising voxel grids
Reference 33
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 303244e1-558e-445b-8f24-694736762545 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Pocket2mol: Efficient molecular sampling based on 3d protein pockets
Reference 34
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation a3b8f302-f1bd-46a0-82f8-b76b8c1bb878 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration MolDiff: Addressing the Atom-Bond Inconsistency Problem in 3D Molecule Diffusion Generation
Reference 35
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 9bb84b3e-45aa-43dc-be7c-b462c49d6638 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Geometric deep learning for structure-based ligand design
Reference 36
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 7229f47d-e83e-4b4f-9ddb-0d06fc7db79a · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Molcraft: Structure-based drug design in continuous parameter space
Reference 37
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 40e7c504-d5ca-44ff-bb22-caf082a2701b · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Generating 3d molecules con- ditional on receptor binding sites with deep generative models
Reference 38
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 539b5194-2d31-4058-896d-677fa4aba21d · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Structure-based drug design with equivariant diffusion models, 2023
Reference 39
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 916f60f3-f3d0-4a6a-9a44-818136a284f7 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Structure-based drug design with equivariant diffusion models
Reference 40
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 80e0e365-2cc7-4269-af1e-7514071941a0 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration On the Pitfalls of Heteroscedastic Uncertainty Estimation with Probabilistic Neural Networks
Reference 41
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 1b4e9a2e-f68c-40de-93cf-2055dd84b713 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Tacogfn: Target-conditioned gflownet for structure-based drug design
Reference 42
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 0a13d31b-cfbb-42b0-a166-11c282b495d3 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration TacoGFN: Target-conditioned GFlowNet for Structure-based Drug Design
Reference 43
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 95c506fb-3ed8-416f-80e4-08e8f1cb836f · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration From target to drug: generative modeling for the multimodal structure-based ligand design.Molecular pharmaceutics, 16(10):4282–4291, 2019
Reference 44
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 496a8d85-c63e-467f-a53e-0a3d90e1669c · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Score-Based Generative Modeling through Stochastic Differential Equations
Reference 45
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 8e59c6ef-d98c-4cb6-a9ba-0f55e3d0338d · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Unified generative modeling of 3d molecules with bayesian flow networks
Reference 46
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation d1a15dbc-e954-4b4f-b6c3-59c202c6162e · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Selective optimization of side activities: another way for drug discovery
Reference 47
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 61daa666-f283-4118-8a0d-e766d873e290 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Learning subpocket prototypes for generalizable structure-based drug design
Reference 48
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation e3e189fc-c547-47ab-b1ad-4794fd956ab3 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Molecule generation for target pro- tein binding with structural motifs
Reference 49
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 6fe4ccaf-4330-442b-ad39-5d0e1bbf8f94 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Geometric Deep Learning for Structure-Based Drug Design: A Survey
Reference 50
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 473074fa-b053-4931-abec-30281d4c7a75 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration known unknown
Reference 51
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 637c19c6-7dac-4ef8-8266-19a9b8d8e8d3 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Unresolved cited work
Reference 52
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation b0d98ba8-6690-423c-a925-0a37e10522d4 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Unresolved cited work
Reference 53
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation fdf75671-3e8e-4701-8255-57d0eea07636 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Here h(θi−1, yi, αi) computes the posterior parameter after observing yi with precision αi, given the prior θi−1
Reference 54
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 5c10dfd4-1644-4947-af80-d0435e69b56d · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration In contrast, diffusion models explicitly add random noise to samples at each step to maintain stochasticity
Reference 55
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 66be65b3-41ec-4830-943a-e9d2bffc65f8 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Unresolved cited work
Reference 56
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation 36b354fe-8d4c-4f37-8624-acd9b4bddcb7 · outbound
Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration Only Generation Type
Reference 57
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.
Observation d5d78610-e890-4564-870e-e67b5c4030ad · inbound
Uncertainty-Calibrated Diffusion for Reliable 3D Molecular Graph Generation Controllable 3D Molecular Generation for Structure-Based Drug Design Through Bayesian Flow Networks and Gradient Integration
Reference 7
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-07T06:34:17.273281+00:00.