The inevitable QSAR renaissance

scientific article published on 30 November 2011

The inevitable QSAR renaissance is …
instance of (P31):
scholarly articleQ13442814

External links are
P8978DBLP publication IDjournals/jcamd/Cramer12
P356DOI10.1007/S10822-011-9495-0
P2888exact matchhttps://scigraph.springernature.com/pub.10.1007/s10822-011-9495-0
P932PMC publication ID3268966
P698PubMed publication ID22127732
P5875ResearchGate publication ID51840494

P2093author name stringRichard D Cramer
P2860cites workHow to improve R&D productivity: the pharmaceutical industry's grand challengeQ28314992
On Outliers and Activity Cliffs - Why QSAR Often DisappointsQ28649303
Beware of q2!Q28842863
A MATHEMATICAL CONTRIBUTION TO STRUCTURE-ACTIVITY STUDIES.Q29387463
Topomer CoMFA: a design methodology for rapid lead optimizationQ31126609
Toluidinesulfonamide hypoxia-induced factor 1 inhibitors: alleviating drug-drug interactions through use of PubChem data and comparative molecular field analysis guided synthesis.Q33901205
Integration of diverse data sources for prediction of adverse drug eventsQ34052007
Pushing the boundaries of 3D-QSAR.Q36718321
How not to develop a quantitative structure-activity or structure-property relationship (QSAR/QSPR).Q37526685
How to recognize and workaround pitfalls in QSAR studies: a critical reviewQ37597312
Modeling approaches for ligand-based 3D similarity.Q37855896
Rethinking 3D-QSAR.Q42661891
Capturing structure-activity relationships from chemogenomic spacesQ43730069
Virtual screening for R-groups, including predicted pIC50 contributions, within large structural databases, using Topomer CoMFA.Q45393672
Quantitative Series Enrichment Analysis (QSEA): a novel procedure for 3D-QSAR analysis.Q51892184
Substructural analysis. Novel approach to the problem of drug designQ52908354
On model building in structure-activity relationships. A reexamination of adrenergic blocking activity of beta-halo-beta-arylalkylamines.Q52940373
The trouble with QSAR (or how I learned to stop worrying and embrace fallacy)Q80416269
SAMFA: simplifying molecular description for 3D-QSARQ81336641
3D-QSAR illusionsQ81437679
Is QSAR relevant to drug discovery?Q82811393
Why you should read Dr. Cramer's perspectiveQ83380497
P433issue1
P304page(s)35-38
P577publication date2011-11-30
P1433published inJournal of Computer - Aided Molecular DesignQ15766522
P1476titleThe inevitable QSAR renaissance
P478volume26

Reverse relations

cites work (P2860)
Q38867278A Round Trip from Medicinal Chemistry to Predictive Toxicology
Q49226937A perspective on multi-target drug discovery and design for complex diseases.
Q38206286Advances in quantitative structure-activity relationship models of anti-Alzheimer's agents.
Q30352841Antiprotozoal Nitazoxanide Derivatives: Synthesis, Bioassays and QSAR Study Combined with Docking for Mechanistic Insight.
Q38615086Aromatase inhibitory activity of 1,4-naphthoquinone derivatives and QSAR study.
Q92899539BCL::Mol2D-a robust atom environment descriptor for QSAR modeling and lead optimization
Q26745421Drug Design for CNS Diseases: Polypharmacological Profiling of Compounds Using Cheminformatic, 3D-QSAR and Virtual Screening Methodologies
Q38465124In silico tools used for compound selection during target-based drug discovery and development
Q51092695Insight into the structural requirements of pyrimidine-based phosphodiesterase 10A (PDE10A) inhibitors by multiple validated 3D QSAR approaches.
Q93047984Meta-QSAR: a large-scale application of meta-learning to drug design and discovery
Q38559373Mind the Gap! A Journey towards Computational Toxicology
Q88878929Performance of Machine Learning Algorithms for Qualitative and Quantitative Prediction Drug Blockade of hERG1 channel
Q93202753Prospects of multitarget drug designing strategies by linking molecular docking and molecular dynamics to explore the protein-ligand recognition process
Q28222668QSAR modeling: where have you been? Where are you going to?
Q38630598QSAR studies in the discovery of novel type-II diabetic therapies
Q47549119Quantitative Structure-Activity Relationship Model for HCVNS5B inhibitors based on an Antlion Optimizer-Adaptive Neuro-Fuzzy Inference System
Q89761451Targeting Tumors Using Peptides
Q36848213Three-dimensional QSAR analysis and design of new 1,2,4-oxadiazole antibacterials

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