DeepBindRG: a deep learning based method for estimating effective protein–ligand affinity
Proteins interact with small molecules to modulate several important cellular functions. Many acute diseases were cured by small molecule binding in the active site of protein either by inhibition or activation. Currently, there are several docking programs to estimate the binding position and the b...
Main Authors: | Haiping Zhang, Linbu Liao, Konda Mani Saravanan, Peng Yin, Yanjie Wei |
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Format: | Article |
Language: | English |
Published: |
PeerJ Inc.
2019-07-01
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Series: | PeerJ |
Subjects: | |
Online Access: | https://peerj.com/articles/7362.pdf |
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