Abstract 2485 Automated multiscale milestoning simulation pipeline integrating machine-learned force fields for accelerated drug-target kinetic predictions for accelerated drug discovery
A
Anupam Ojha
S
Sonya Hanson
R
Rommie Amaro
Article Details
Journal
Journal of Biological Chemistry
Volume / Issue
Vol. 301, Issue 5
Published
May 01, 2025
Pages
109072
ISSN
0021-9258
Publisher
Elsevier BV
Authors (3)
A
Anupam Ojha
S
Sonya Hanson
R
Rommie Amaro
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