DeepBindRG: a deep learning based method for estimating effective protein–ligand affinity
出版年份 2019 全文链接
标题
DeepBindRG: a deep learning based method for estimating effective protein–ligand affinity
作者
关键词
-
出版物
PeerJ
Volume 7, Issue -, Pages e7362
出版商
PeerJ
发表日期
2019-07-25
DOI
10.7717/peerj.7362
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- Development and evaluation of a deep learning model for protein–ligand binding affinity prediction
- (2018) Marta M Stepniewska-Dziubinska et al. BIOINFORMATICS
- OUP accepted manuscript
- (2018) BIOINFORMATICS
- Statistical and machine learning approaches to predicting protein–ligand interactions
- (2018) Lucy J Colwell CURRENT OPINION IN STRUCTURAL BIOLOGY
- Drug-Target Interactions: Prediction Methods and Applications
- (2018) Shanmugam Anusuya et al. CURRENT PROTEIN & PEPTIDE SCIENCE
- KDEEP: Protein–Ligand Absolute Binding Affinity Prediction via 3D-Convolutional Neural Networks
- (2018) José Jiménez et al. Journal of Chemical Information and Modeling
- Assessing protein–ligand interaction scoring functions with the CASF-2013 benchmark
- (2018) Yan Li et al. Nature Protocols
- Protein–Ligand Scoring with Convolutional Neural Networks
- (2017) Matthew Ragoza et al. Journal of Chemical Information and Modeling
- Performance of machine-learning scoring functions in structure-based virtual screening
- (2017) Maciej Wójcikowski et al. Scientific Reports
- Deep learning in bioinformatics
- (2016) Seonwoo Min et al. BRIEFINGS IN BIOINFORMATICS
- Insights into Protein–Ligand Interactions: Mechanisms, Models, and Methods
- (2016) Xing Du et al. INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES
- MOLS 2.0: software package for peptide modeling and protein–ligand docking
- (2016) D. Sam Paul et al. JOURNAL OF MOLECULAR MODELING
- Folding RaCe: a robust method for predicting changes in protein folding rates upon point mutations
- (2015) Priyashree Chaudhary et al. BIOINFORMATICS
- Deep learning
- (2015) Yann LeCun et al. NATURE
- Machine-learning scoring functions to improve structure-based binding affinity prediction and virtual screening
- (2015) Qurrat Ul Ain et al. Wiley Interdisciplinary Reviews-Computational Molecular Science
- PDB-wide collection of binding data: current status of the PDBbind database
- (2014) Zhihai Liu et al. BIOINFORMATICS
- Comparative Assessment of Scoring Functions on an Updated Benchmark: 2. Evaluation Methods and General Results
- (2014) Yan Li et al. Journal of Chemical Information and Modeling
- Complex diseases require complex therapies
- (2013) Ravi Iyengar EMBO REPORTS
- CSAR Data Set Release 2012: Ligands, Affinities, Complexes, and Docking Decoys
- (2013) James B. Dunbar et al. Journal of Chemical Information and Modeling
- Mechanisms and insights into drug resistance in cancer
- (2013) Hiba Zahreddine et al. Frontiers in Pharmacology
- Sanjeevini: a freely accessible web-server for target directed lead molecule discovery
- (2012) B Jayaram et al. BMC BIOINFORMATICS
- Directory of Useful Decoys, Enhanced (DUD-E): Better Ligands and Decoys for Better Benchmarking
- (2012) Michael M. Mysinger et al. JOURNAL OF MEDICINAL CHEMISTRY
Publish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn MoreFind the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
Search