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| README | https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#introduction-to-bioinformaticscheminformatics |
| An Introduction to Statistical Learning | http://www-bcf.usc.edu/~gareth/ISL/ |
| Machine Learning course at Coursera | https://www.coursera.org/learn/machine-learning |
| R & Bioconductor Manual | http://manuals.bioinformatics.ucr.edu/home/R_BioCondManual/ |
| https://statquest.org/video-index/ | https://statquest.org/video-index/ |
| HT Sequence Analysis with R and Bioconductor | http://manuals.bioinformatics.ucr.edu/home/ht-seq |
| ChemmineR: Cheminformatics Toolkit for R | http://www.bioconductor.org/packages/devel/bioc/vignettes/ChemmineR/inst/doc/ChemmineR.html |
| Step by Step to practice deep learning | http://pytorch.org/tutorials/beginner/deep_learning_60min_blitz.html |
| Introduction to Bioinformatics and Computational Biology | https://liulab-dfci.github.io/bioinfo-combio/ |
| HarvardX Biomedical Data Science Open Online Training | http://rafalab.github.io/pages/harvardx.html |
| Statistics for biologists from StatQuest | https://statquest.org/video-index/ |
| Data Science Cheat Sheet | https://github.com/Bin-Chen-Lab/BigData_AI_DrugDiscovery/blob/master/data_science_cheatsheet.pdf |
| osca | https://osca.bioconductor.org/introduction.html |
| seurat | https://satijalab.org/seurat/vignettes.html |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#fundamental-papers |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#field-review |
| Hallmarks of Cancer: The Next Generation | http://www.cell.com/abstract/S0092-8674%2811%2900127-9 |
| Tumor Metastasis: Molecular Insights and Evolving Paradigms | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3261217/ |
| Cancer genome landscapes | http://science.sciencemag.org/content/339/6127/1546.long |
| Cancer transcriptome profiling at the juncture of clinical translation | https://www.nature.com/articles/nrg.2017.96 |
| Ewing sarcoma: historical perspectives, current state-of-the-art, and opportunities for targeted therapy in the future. | https://www.ncbi.nlm.nih.gov/pubmed/18525337 |
| Opportunities and challenges in phenotypic drug discovery: an industry perspective | https://www.nature.com/nrd/journal/v16/n8/abs/nrd.2017.111.html |
| Ten Years of Pathway Analysis: Current Approaches and Outstanding Challenges | http://journals.plos.org/ploscompbiol/article?id=10.1371/journal.pcbi.1002375 |
| Deep learning | https://www.nature.com/nature/journal/v521/n7553/full/nature14539.html |
| High-performance medicine: the convergence of human and artificial intelligence | https://www.nature.com/articles/s41591-018-0300-7 |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#statistical-method-development |
| Significance analysis of microarrays applied to the ionizing radiation response | http://www.pnas.org/content/98/9/5116.full |
| limma: Linear Models for Microarray Data | https://link.springer.com/chapter/10.1007/0-387-29362-0_23 |
| Differential expression analysis for sequence count data | https://genomebiology.biomedcentral.com/articles/10.1186/gb-2010-11-10-r106 |
| Gene set enrichment analysis: a knowledge-based approach for interpreting genome-wide expression profiles | http://www.pnas.org/content/102/43/15545.long |
| Adjusting batch effects in microarray expression data using Empirical Bayes methods | https://academic.oup.com/biostatistics/article/8/1/118/252073/Adjusting-batch-effects-in-microarray-expression |
| Emergence of Scaling in Random Networks | http://science.sciencemag.org/content/286/5439/509.full |
| Pathsim: Meta path-based top-k similarity search in heterogeneous information networks | http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.220.2455 |
| MuSiC: Identifying mutational significance in cancer genomes | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3409272/ |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#informatics-method-development-and-application |
| The Connectivity Map: using gene-expression signatures to connect small molecules, genes, and disease. | http://science.sciencemag.org/content/313/5795/1929.long |
| Discovery and Preclinical Validation of Drug Indications Using Compendia of Public Gene Expression Data | http://stm.sciencemag.org/content/3/96/96ra77 |
| Relating protein pharmacology by ligand chemistry | http://www.nature.com/nbt/journal/v25/n2/full/nbt1284.html |
| Characterization of drug-induced transcriptional modules: towards drug repositioning and functional understanding | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3658274/ |
| Cross-Species Regulatory Network Analysis Identifies a Synergistic Interaction between FOXM1 and CENPF that Drives Prostate Cancer Malignancy | http://www.cell.com/cancer-cell/fulltext/S1535-6108(14)00125-1 |
| Elucidating compound mechanism of action by network perturbation analysis | http://www.sciencedirect.com/science/article/pii/S0092867415006996 |
| Discovery of drug mode of action and drug repositioning from transcriptional responses | http://www.pnas.org/content/107/33/14621.long |
| Imagenet classification with deep convolutional neural networks | http://papers.nips.cc/paper/4824-imagenet-classification-with-deep-convolutional-neural-networks.pdf |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#computational-analysis |
| Drug-target network | https://www.nature.com/nbt/journal/v25/n10/full/nbt1338.html |
| Comprehensive molecular portraits of human breast tumours | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3465532/ |
| Mutational landscape and significance across 12 major cancer types. | http://dx.doi.org/10.1038/nature12634 |
| Comprehensive Characterization of Molecular Differences in Cancer between Male and Female Patients | http://www.cell.com/cancer-cell/fulltext/S1535-6108(16)30111-8 |
| Genetics of rheumatoid arthritis contributes to biology and drug discovery. | https://www.nature.com/nature/journal/v506/n7488/full/nature12873.html |
| The Cancer Cell Line Encyclopedia enables predictive modelling of anticancer drug sensitivity | https://www.nature.com/nature/journal/v483/n7391/full/nature11003.html |
| A comprehensive time-course–based multicohort analysis of sepsis and sterile inflammation reveals a robust diagnostic gene set | http://stm.sciencemag.org/content/7/287/287ra71.short |
| Prediction of biological targets for compounds using multiple-category Bayesian models trained on chemogenomics databases | http://pubs.acs.org/doi/10.1021/ci060003g |
| Do structurally similar molecules have similar biological activity | https://dx.doi.org/10.1021/jm020155c |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#deep-learning-based-drug-discovery |
| Predicting Drug Response and Synergy Using a Deep Learning Model of Human Cancer Cells | https://pubmed.ncbi.nlm.nih.gov/33096023/ |
| A Deep Learning Approach to Antibiotic Discovery | https://pubmed.ncbi.nlm.nih.gov/32084340/ |
| Deep reinforcement learning for de novo drug design | http://advances.sciencemag.org/content/4/7/eaap7885 |
| Convolutional Networks on Graphs for Learning Molecular Fingerprints | https://arxiv.org/abs/1509.09292 |
| Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules | https://pubs.acs.org/doi/full/10.1021/acscentsci.7b00572 |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#shape-our-future |
| Single-cell RNA-seq highlights intratumoral heterogeneity in primary glioblastoma | http://science.sciencemag.org/content/344/6190/1396 |
| Single-cell transcriptomics uncovers distinct molecular signatures of stem cells in chronic myeloid leukemia | https://www.nature.com/nm/journal/v23/n6/full/nm.4336.html |
| Brown Adipogenic Reprogramming Induced by a Small Molecule | http://www.sciencedirect.com/science/article/pii/S2211124716317697 |
| Correlating chemical sensitivity and basal gene expression reveals mechanism of action. | https://www.nature.com/nchembio/journal/v12/n2/full/nchembio.1986.html |
| A Next Generation Connectivity Map: L1000 Platform And The First 1,000,000 Profiles | https://www.biorxiv.org/content/early/2017/05/10/136168 |
| Integrative clinical genomics of metastatic cancer | http://www.nature.com/nature/journal/v548/n7667/full/nature23306.html |
| Unpaired Image-to-Image Translation using Cycle-Consistent Adversarial Networks | https://arxiv.org/pdf/1703.10593.pdf |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#outstanding-tools-and-datasets-for-translational-drug-discovery |
| Harnessing big ‘omics’ data and AI for drug discovery in hepatocellular carcinoma | https://www.nature.com/articles/s41575-019-0240-9 |
| Leveraging big data to transform target selection and drug discovery | http://www.ncbi.nlm.nih.gov/pubmed/26659699 |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#diseasespatients |
| ClinicalTrials.gov | https://clinicaltrials.gov |
| Cancer Today (Globocan): Data visualization tools that present current national estimates of cancer incidence, mortality, and prevalence | http://gco.iarc.fr/today/home |
| UK Biobank | http://www.ukbiobank.ac.uk/ |
| UK Biobank Engine | https://biobankengine.stanford.edu/ |
| COSMIC | http://cancer.sanger.ac.uk/cosmic |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#target-discovery |
| cBioPortal | http://www.cbioportal.org/ |
| GTEx | http://www.gtexportal.org |
| The Human Protein Atlas | https://www.proteinatlas.org/ |
| Cancer Cell Line Encyclopedia | https://portals.broadinstitute.org/ccle |
| Project Achilles | https://portals.broadinstitute.org/achilles |
| DepMap | https://depmap.org/portal/ |
| GEO | https://www.ncbi.nlm.nih.gov/geo/ |
| Enrichr | http://amp.pharm.mssm.edu/Enrichr/ |
| STRING DB | https://string-db.org/ |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#drug-discovery |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/ |
| DrugBank | https://www.drugbank.ca/ |
| SEA | http://sea.bkslab.org/ |
| LINCS | https://clue.io/ |
| ChemMine | http://chemmine.ucr.edu/ |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#ngs-analysis |
| RNASEQ blog | http://www.rna-seqblog.com/ |
| RPKM, FPKM and TPM, clearly explained | http://www.rna-seqblog.com/rpkm-fpkm-and-tpm-clearly-explained/ |
| RNA-seq workflow: gene-level exploratory analysis and differential expression | http://www.bioconductor.org/help/workflows/rnaseqGene/ |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#python-packages |
| anaconda | https://anaconda.org/ |
| scikit: a popular python machine learning packages | http://scikit-learn.org/stable/ |
| rdkit | http://www.rdkit.org/docs/index.html |
| PyTorch | http://pytorch.org/ |
| https://patch-diff.githubusercontent.com/Bin-Chen-Lab/Awesome_BigData_AI_DrugDiscovery#rbioconductor-packages |
| ggplot cheatsheet | http://zevross.com/blog/2014/08/04/beautiful-plotting-in-r-a-ggplot2-cheatsheet-3/ |
| ChemmineR: Cheminformatics Toolkit for R | http://www.bioconductor.org/packages/devel/bioc/vignettes/ChemmineR/inst/doc/ChemmineR.html |
| biomaRt | http://bioconductor.org/packages/release/bioc/html/biomaRt.html |
| GEOquery | http://bioconductor.org/packages/release/bioc/html/GEOquery.html |
| cgdsr | https://cran.r-project.org/web/packages/cgdsr/index.html |
| pheatmap | https://cran.r-project.org/web/packages/pheatmap/index.html |
| Easy Way to Mix Multiple Graphs on The Same Page | http://www.sthda.com/english/articles/24-ggpubr-publication-ready-plots/81-ggplot2-easy-way-to-mix-multiple-graphs-on-the-same-page/ |
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Readme
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