Self-Focusing Virtual Screening with Active Design Space Pruning-Reference-Cited by-同舟云学术

Self-Focusing Virtual Screening with Active Design Space Pruning

Author:

Graff David E.¹²,Aldeghi Matteo²^ORCID,Morrone Joseph A.³^ORCID,Jordan Kirk E.⁴,Pyzer-Knapp Edward O.⁵^ORCID,Coley Connor W.²⁶^ORCID

Affiliation:

1. Department of Chemistry and Chemical Biology, Harvard University, Cambridge, Massachusetts 02138, United States

2. Department of Chemical Engineering, MIT, Cambridge, Massachusetts 02142, United States

3. Computational Biology Center, IBM Thomas J. Watson Research Center, Yorktown Heights, New York 10594, United States

4. IBM Thomas J. Watson Research Center, Cambridge, Massachusetts 02142, United States

5. IBM Research Europe, Daresbury, Warrington WA4 4AD, United Kingdom

6. Department of Electrical Engineering and Computer Science, MIT, Cambridge, Massachusetts 02142, United States

Funder

MIT-IBM Watson AI Lab

Publisher

American Chemical Society (ACS)

Subject

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

Link

Reference47 articles.

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