Update README.md
Browse files
README.md
CHANGED
|
@@ -77,13 +77,16 @@ The field "labels" contains the following quantities (in this order) for each it
|
|
| 77 |
|
| 78 |
## Citation Information
|
| 79 |
|
|
|
|
| 80 |
@article{townshend2020atom3d,
|
| 81 |
title={Atom3d: Tasks on molecules in three dimensions},
|
| 82 |
author={Townshend, Raphael JL and V{\"o}gele, Martin and Suriana, Patricia and Derry, Alexander and Powers, Alexander and Laloudakis, Yianni and Balachandar, Sidhika and Jing, Bowen and Anderson, Brandon and Eismann, Stephan and others},
|
| 83 |
journal={arXiv preprint arXiv:2012.04035},
|
| 84 |
year={2020}
|
| 85 |
}
|
|
|
|
| 86 |
|
|
|
|
| 87 |
@article{nandi2023multixc,
|
| 88 |
title={MultiXC-QM9: Large dataset of molecular and reaction energies from multi-level quantum chemical methods},
|
| 89 |
author={Nandi, Surajit and Vegge, Tejs and Bhowmik, Arghya},
|
|
@@ -94,7 +97,9 @@ The field "labels" contains the following quantities (in this order) for each it
|
|
| 94 |
year={2023},
|
| 95 |
publisher={Nature Publishing Group UK London}
|
| 96 |
}
|
|
|
|
| 97 |
|
|
|
|
| 98 |
@article{ruddigkeit2012enumeration,
|
| 99 |
title={Enumeration of 166 billion organic small molecules in the chemical universe database GDB-17},
|
| 100 |
author={Ruddigkeit, Lars and Van Deursen, Ruud and Blum, Lorenz C and Reymond, Jean-Louis},
|
|
@@ -104,4 +109,5 @@ The field "labels" contains the following quantities (in this order) for each it
|
|
| 104 |
pages={2864--2875},
|
| 105 |
year={2012},
|
| 106 |
publisher={ACS Publications}
|
| 107 |
-
}
|
|
|
|
|
|
| 77 |
|
| 78 |
## Citation Information
|
| 79 |
|
| 80 |
+
```
|
| 81 |
@article{townshend2020atom3d,
|
| 82 |
title={Atom3d: Tasks on molecules in three dimensions},
|
| 83 |
author={Townshend, Raphael JL and V{\"o}gele, Martin and Suriana, Patricia and Derry, Alexander and Powers, Alexander and Laloudakis, Yianni and Balachandar, Sidhika and Jing, Bowen and Anderson, Brandon and Eismann, Stephan and others},
|
| 84 |
journal={arXiv preprint arXiv:2012.04035},
|
| 85 |
year={2020}
|
| 86 |
}
|
| 87 |
+
```
|
| 88 |
|
| 89 |
+
```
|
| 90 |
@article{nandi2023multixc,
|
| 91 |
title={MultiXC-QM9: Large dataset of molecular and reaction energies from multi-level quantum chemical methods},
|
| 92 |
author={Nandi, Surajit and Vegge, Tejs and Bhowmik, Arghya},
|
|
|
|
| 97 |
year={2023},
|
| 98 |
publisher={Nature Publishing Group UK London}
|
| 99 |
}
|
| 100 |
+
```
|
| 101 |
|
| 102 |
+
```
|
| 103 |
@article{ruddigkeit2012enumeration,
|
| 104 |
title={Enumeration of 166 billion organic small molecules in the chemical universe database GDB-17},
|
| 105 |
author={Ruddigkeit, Lars and Van Deursen, Ruud and Blum, Lorenz C and Reymond, Jean-Louis},
|
|
|
|
| 109 |
pages={2864--2875},
|
| 110 |
year={2012},
|
| 111 |
publisher={ACS Publications}
|
| 112 |
+
}
|
| 113 |
+
```
|