Benchmarking Refined and Unrefined AlphaFold2 Structures for Hit Discovery-Reference-Cited by-同舟云学术

Benchmarking Refined and Unrefined AlphaFold2 Structures for Hit Discovery

Published:2023-03-10 Issue:6 Volume:63 Page:1656-1667
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Zhang Yuqi¹^ORCID,Vass Marton²,Shi Da¹^ORCID,Abualrous Esam³,Chambers Jennifer M.⁴,Chopra Nikita¹,Higgs Christopher¹,Kasavajhala Koushik⁵,Li Hubert¹,Nandekar Prajwal⁵^ORCID,Sato Hideyuki⁶,Miller Edward B.⁴^ORCID,Repasky Matthew P.⁷^ORCID,Jerome Steven V.¹^ORCID

Affiliation:

1. Schrödinger Inc., 9868 Scranton Road, Suite3200, San Diego, California 92121, United States

2. Schrödinger Technologies Limited, Nine Hills Road, Cambridge CB2 1GE, United Kingdom

3. Schrödinger GmbH, Glücksteinallee 25, Mannheim 68159, Germany

4. Schrödinger Inc., 1540 Broadway, 24th Floor, New York, New York 10036, United States

5. Schrödinger India Private Limited, No: #147, 3rd Floor, Jawaharlal Nehru Main Road, Channasandra 5th Stage Rajarajeswari Nagar, Above State Bank of India, Bengaluru, India 560098

6. Schrödinger KK, 13F Marunouchi Trust Tower North, 1-8-1 Marunouchi, Chiyoda-ku, Tokyo 100-0005, Japan

7. Schrödinger Inc., 101 SW Main Street, #1300, Portland, Oregon 97239, United States

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.2c01219

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