A consistent description of HYdrogen bond and DEhydration energies in protein–ligand complexes: methods behind the HYDE scoring function
出版年份 2012 全文链接
标题
A consistent description of HYdrogen bond and DEhydration energies in protein–ligand complexes: methods behind the HYDE scoring function
作者
关键词
Protein–ligand interactions, Desolvation, Binding affinity, Virtual screening, Lead optimization, Docking
出版物
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
Volume 27, Issue 1, Pages 15-29
出版商
Springer Nature
发表日期
2012-12-26
DOI
10.1007/s10822-012-9626-2
参考文献
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