RediscMol: Benchmarking Molecular Generation Models in Biological Properties-Reference-Cited by-同舟云学术

RediscMol: Benchmarking Molecular Generation Models in Biological Properties

Published:2024-01-05 Issue:2 Volume:67 Page:1533-1543
ISSN:0022-2623
Container-title:Journal of Medicinal Chemistry
language:en
Short-container-title:J. Med. Chem.

Author:

Weng Gaoqi¹,Zhao Huifeng¹,Nie Dou¹,Zhang Haotian¹,Liu Liwei²,Hou Tingjun¹^ORCID,Kang Yu¹^ORCID

Affiliation:

1. Innovation Institute for Artificial Intelligence in Medicine of Zhejiang University, College of Pharmaceutical Sciences, Zhejiang UniversityHangzhou 310058, Zhejiang, China

2. Advanced Computing and Storage Laboratory, Central Research Institute, 2012 Laboratories, Huawei Technologies Co., Ltd., Shenzhen 518129, Guangdong, China

Funder

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jmedchem.3c02051

Reference35 articles.

1. Virtual Compound Libraries in Computer-Assisted Drug Discovery

2. ZINC20—A Free Ultralarge-Scale Chemical Database for Ligand Discovery

3. PubChem 2023 update

4. ChEMBL: towards direct deposition of bioassay data

5. PROTAC-DB 2.0: an updated database of PROTACs

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