Add LEADERBOARD.md
Browse files- LEADERBOARD.md +5 -5
LEADERBOARD.md
CHANGED
|
@@ -2,7 +2,7 @@
|
|
| 2 |
|
| 3 |
Blind structure elucidation from **molecular formula + IR + ¹H + ¹³C** peak lists exactly as reported in open-access papers. Constitution scoring uses RDKit InChIKey connectivity (first 14 characters) unless noted.
|
| 4 |
|
| 5 |
-
**Paper:** [
|
| 6 |
|
| 7 |
---
|
| 8 |
|
|
@@ -122,12 +122,12 @@ If you use IRSpectra-Bench or report numbers on it, please cite:
|
|
| 122 |
|
| 123 |
```bibtex
|
| 124 |
@article{yabbarov2026irspectra,
|
| 125 |
-
title = {
|
| 126 |
-
|
| 127 |
author = {Yabbarov, Ilkham and Sondhi, Rudra and Vargas-Hern{\'a}ndez, Rodrigo A.},
|
| 128 |
year = {2026},
|
| 129 |
-
note = {Manuscript in preparation}
|
| 130 |
}
|
| 131 |
```
|
| 132 |
|
| 133 |
-
*Last updated: 2026-08-
|
|
|
|
| 2 |
|
| 3 |
Blind structure elucidation from **molecular formula + IR + ¹H + ¹³C** peak lists exactly as reported in open-access papers. Constitution scoring uses RDKit InChIKey connectivity (first 14 characters) unless noted.
|
| 4 |
|
| 5 |
+
**Paper:** [IRexp and IRSpectra-Bench](https://github.com/IlkhamFY/spectro-agent) (manuscript in preparation, 2026).
|
| 6 |
|
| 7 |
---
|
| 8 |
|
|
|
|
| 122 |
|
| 123 |
```bibtex
|
| 124 |
@article{yabbarov2026irspectra,
|
| 125 |
+
title = {{IRexp} and {IRSpectra-Bench}: redistributable experimental {IR} band lists,
|
| 126 |
+
a blind peak-list benchmark, and a recall-bound diagnosis of {LLM} elucidation},
|
| 127 |
author = {Yabbarov, Ilkham and Sondhi, Rudra and Vargas-Hern{\'a}ndez, Rodrigo A.},
|
| 128 |
year = {2026},
|
| 129 |
+
note = {Manuscript in preparation; target J. Chem. Inf. Model.}
|
| 130 |
}
|
| 131 |
```
|
| 132 |
|
| 133 |
+
*Last updated: 2026-08-25 (JCIM editorial strengthen). External submissions listed after verification.*
|