Typed states for the displayed outbound observations.
Source: paper_references, paper_reference_links, observed 2026-08-10T20:14:54.556974Z
Paper Citation Record · LEDGER
As of 17 August 2026, this Paper Citation Record lists 53 of 53 outbound references and 0 inbound Pith citation observations for arXiv:2501.09103.
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 2026-08-10T20:14:54.556974Z
One-hop event checks from named stored sources.
Source: scholarly_work_events, retraction_status_cache, observed 2026-08-17T06:30:58.91139+00:00
Pith citing papers itemized under the disclosed page cap.
Source: paper_references, paper_reference_links
A source-named dated measurement, never combined with another source.
Source: cited_works
53 of 53 outbound references displayed
External citation measurements
No source-named external measurement is stored.
Observation 73db602a-e420-4afd-a126-88cad26056df · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Geometric deep learning on molecular repre- sentations
Reference 1
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 410cfad2-99c2-4e01-b2b4-c9e972de313b · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Schoenholz, Patrick F
Reference 2
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation b0b472d9-9bf2-4c85-b62d-04355ddeb542 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Analyzing learned molecular representations for property prediction
Reference 3
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 5a3626c4-e12b-418b-a175-2ba999868ec2 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Pushing the boundaries of molecular representation for drug discovery with the graph attention mechanism
Reference 4
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation e80df15f-0069-4257-b974-7cd6db8eb9fd · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Spherical message passing for 3D molecular graphs
Reference 5
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 831a1df5-cab2-48d0-af75-19af9e59615f · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Unresolved cited work
Reference 6
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation b0d3465d-aae1-4ca3-a39f-b7fbfe832806 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction E(n) equivariant graph neural networks,
Reference 7
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 424c92bb-c460-4bb2-80bf-00b8bb889900 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction SMILES-BERT: Large scale unsupervised pre-training for molecular property prediction
Reference 8
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation bc7c3f52-25d3-432e-9ba7-2b8130402b14 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction SMILES Transformer: Pre-trained Molecular Fingerprint for Low Data Drug Discovery
Reference 9
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 1e708c81-a11b-4e62-886d-1f4aefa699bc · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction RoBERTa: A robustly optimized BERT pretraining approach,
Reference 10
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 19359063-225a-458c-926d-ce062c342f86 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction ChemBERTa: Large-Scale Self-Supervised Pretraining for Molecular Property Prediction
Reference 11
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation e0ecb1c2-2b30-438a-8c9c-a7160c2d4947 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Large-scale chemical language representations capture molecular structure and properties
Reference 12
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 0768a674-9bd1-4338-b842-0898b9ffcb63 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Chuang, Laura M
Reference 13
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation de13e517-ba49-41be-b9aa-07d869af003b · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Fundamentals of Medicinal Chemistry
Reference 14
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation d60ed8c7-5da5-45cf-8ccb-d57bf149f901 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Matched molecular pair analysis in drug discovery: Methods and recent applications
Reference 15
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 0949cfb4-41e3-430f-961e-b8842b8c33d6 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction A systematic study of key elements underlying molecular property prediction
Reference 16
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 72bac261-5c22-4474-85db-6e239b9f58d5 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Unresolved cited work
Reference 17
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation c7f64bab-bc2a-4585-8f0d-4c092e9d93a6 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction MaskMol: Knowledge-guided molecular image pre-training framework for activity cliffs with pixel masking
Reference 18
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 208f7b71-4191-4d24-a7a0-f6fe08421bfd · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Prediction of activity cliffs on the basis of images using convolutional neural networks
Reference 19
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 7fcb63ef-b145-4d4c-a677-c6f7caf9b374 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Prediction of activity cliffs using condensed graphs of reaction representations, descriptor recombination, support vector machine classification, and support vector regression
Reference 21
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 4a9e33e9-1405-4a94-b1a7-3dc19df16e78 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Exploring qsar models for activity- cliff prediction
Reference 22
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 2ebd71b3-2a0d-4391-a038-6c4b886f2d19 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Exposing the limitations of molecular machine learning with activity cliffs
Reference 23
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 82eab794-8301-4d9f-a34b-82c14849e39f · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Metric Learning: A Survey
Reference 24
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation a6d1a6a4-17e2-498c-9e56-6e705be53683 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Learning to Rank for Information Retrieval
Reference 25
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 5d0102b4-5b44-428a-97bc-c2b970b5cd5f · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Unresolved cited work
Reference 26
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation f3a110ed-ac09-408a-8700-f80af4925ff2 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Few-shot learning for low-data drug discovery.Journal of Chemical Information and Modeling, 63(1):27–42, 2023
Reference 27
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation e0d03210-c644-4832-8813-9397de3778f1 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction FS-Mol: A few-shot learning dataset of molecules
Reference 28
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 8905b531-6995-4825-8cee-582c13a15fd8 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Implicitly Guided Design with PropEn: Match your Data to Follow the Gradient
Reference 29
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 446927ab-8908-42e7-b487-d3729230b1c5 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Pappu, and Vijay Pande
Reference 30
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 226c3061-c377-41b3-84e8-4c10b7e5c974 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Twin neural network regression is a semi- supervised regression algorithm
Reference 31
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation e690746e-71f5-49e5-b509-daacdda5c3c8 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Pairwise Difference Learning for Classification
Reference 32
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 2ae1e86b-e81f-46bb-8a4c-a6b0e39fb727 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Burrill, Enrique R
Reference 33
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation c61a4a58-17d1-4a01-93a6-9124cd47c007 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Twin neural network regression
Reference 34
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 17eba87d-5566-4734-b2e7-d891f3a0713b · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Finding the most potent compounds using active learning on molecular pairs
Reference 35
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation da2c350b-4255-4b12-81dc-121b033057c7 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Random forests
Reference 36
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 12b0ad0f-4135-4381-936f-591a0ceeb570 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction XGBoost: A scalable tree boosting system
Reference 37
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 12a871ca-508d-48ef-9cb2-73bff054a599 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction DeepDelta: predicting ADMET improve- ments of molecular derivatives with deep learning
Reference 38
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 7d94659d-7917-49ad-87f0-34017f812dd6 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction RDKit: Open-source cheminformatics software, 2016
Reference 39
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation ffc1bd65-894a-408f-b58d-b6e9f9b6f6c6 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Strategies for pre-training graph neural networks
Reference 40
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 520317f4-2187-4bf3-83da-542a2740736c · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Prin- cipal neighbourhood aggregation for graph nets
Reference 41
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 5cac2628-d746-454d-9027-a18955377b8b · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Extended-connectivity fingerprints
Reference 42
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation fc9f4942-dc6b-4a54-9c57-6ef0680c5e43 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Williams, Carl Underkoffler, Ryan Pederson, Narbe Mardirossian, Ian Watson, and John Parkhill
Reference 43
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 52f72154-c646-4773-aa44-d47be769e04a · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Gotta be SAFE: A New Framework for Molecular Design
Reference 44
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation b589eeba-c994-44c0-a029-28d50d2c7c4e · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Uni-Mol: A universal 3D molecular representation learning framework
Reference 45
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 0364801f-a34f-4fdf-a9f2-b576843afc4a · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Systematic benchmark of substructure search in molecular graphs - from Ullmann to VF2
Reference 46
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 036cde0d-4044-4ece-9ec4-1e0b4c89a511 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction URL https://proceedings.neurips.cc/paper/2020/file/ 99cad265a1768cc2dd013f0e740300ae-Paper.pdf
Reference 47
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 2b626685-69b0-4dde-854f-819e6a477083 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Molecular contrastive learning of representations via graph neural networks
Reference 48
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 2448fa9a-989e-4772-b4c8-7492c344aebd · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Pedregosa, G
Reference 53
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation 3b4af83f-b7e9-44b5-81fd-8d8983553359 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction A Appendix A.1 Models We used the following models to evaluate the effectiveness of the SQRL approach: Baselines
Reference 2011
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation c4e8deef-c880-44d0-bad3-141a0ebd6ac7 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Unresolved cited work
Reference 2013
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 06fd9ba7-d77e-4937-9e47-27e2edb310f4 · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction RoBERTa: A Robustly Optimized BERT Pretraining Approach
Reference 2019
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
Observation 2f546c37-a5cd-46b8-bda3-d291ac3036dc · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction Unresolved cited work
Reference 2020
Source-reported events for the cited work
No event found in the named queried sources as of 2026-08-17T06:30:58.91139+00:00.
Observation fd55eec1-3d35-42da-b4e9-a6a9f80f001b · outbound
Similarity-Quantized Relative Difference Learning for Improved Molecular Activity Prediction E(n) Equivariant Graph Neural Networks
Reference 2022
Source-reported events for the cited work
Unavailable: canonical work link unavailable.
No inbound Pith citation observations are available.