A robust crystal structure prediction method to support small molecule drug development with large scale validation and blind study
D
Dong Zhou
I
Imanuel Bier
B
Biswajit Santra
L
Leif D. Jacobson
C
Chuanjie Wu
A
Adiran Garaizar Suarez
B
Barbara Ramirez Almaguer
H
Haoyu Yu
R
Robert Abel
R
Richard A. Friesner
L
Lingle Wang
Article Details
Journal
Nature Communications
Volume / Issue
Vol. 16, Issue 1
Published
March 05, 2025
ISSN
2041-1723
Publisher
Nature Portfolio
Authors (11)
D
Dong Zhou
I
Imanuel Bier
B
Biswajit Santra
L
Leif D. Jacobson
C
Chuanjie Wu
A
Adiran Garaizar Suarez
B
Barbara Ramirez Almaguer
H
Haoyu Yu
R
Robert Abel
R
Richard A. Friesner
L
Lingle Wang
Related Articles from this Journal
Synthesis of adaptive 15N-nitrosyl-Co7 nanocluster for electrocatalytic C–H functionalization
Chao Wu, Xu Zhang et al.
Aug 2026
10.1038/s41467-026-76516-1
Pan-Ebolavirus nanoparticle vaccine provides protection in rodents from lethal infection by Zaire and Sudan viruses
Connor Weidle, Natalie Brunette et al.
Aug 2026
10.1038/s41467-026-76114-1
Multi-population GWAS meta-analysis identifies bladder cancer susceptibility loci and highlights genetic regulation of smoking-related risk
Ludmila Prokunina-Olsson, Oscar Florez-Vargas et al.
Aug 2026
10.1038/s41467-026-76157-4
Genome-wide annotation of human multi-nucleotide variants reveals widespread functional differences from single nucleotide variants
Weiwei Jin, Wen Cao et al.
Aug 2026
10.1038/s41467-026-76470-y
Allele-specific chromatin architecture shapes imprinted domains and coordinates a distal enhancer and antisense transcription at the mouse Mest-Copg2 domain
Bongmin Bae, Katherine Gu et al.
Aug 2026
10.1038/s41467-026-76506-3