#QSAR

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One way to estimate the price a compound, using #QSAR https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00747 … though it seems a more direct approach via a retrosynthetic path prediction would be more explicit #cheminformatics

There's still time to register to attend our 51st ICGM, to be held in Baltimore, USA, next month! Join us for a day of presentations, interactive workshop sessions and networking. http://bit.ly/2Si5Als  #InSilico #Computational #Toxicology #QSAR #LhasaLimited #DrugDevelopment

There's still time to register to attend our 51st ICGM, to be held in Baltimore, USA, next month! Join us for a day of presentations, interactive workshop sessions and networking. http://bit.ly/2Si5Als  #InSilico #Computational #Toxicology #QSAR #LhasaLimited #DrugDevelopment

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recruiting postdoc for #qsar at #DTU #Copenhagen #Denmark

Read this open access paper on 'Avoiding hERG-liability in drug design via synergetic combinations of different (Q)SAR methodologies and data sources: a case study in an industrial setting', by Lhasa Scientist Thierry Hanser, et al. http://bit.ly/2Dvo6wa  #InSilico #Paper #QSAR

Read this open access paper on 'Avoiding hERG-liability in drug design via synergetic combinations of different (Q)SAR methodologies and data sources: a case study in an industrial setting', by Lhasa Scientist Thierry Hanser, et al. http://bit.ly/2Dvo6wa  #InSilico #Paper #QSAR

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Have a look at BMFpred, our free tool implementing the #QSAR models proposed by @fra_grisoni in https://bit.ly/2E53Ov6 
#alvascience #BMF
https://bit.ly/2SqUydF 

Have a look at BMFpred, our free tool implementing the #QSAR models proposed by @fra_grisoni in https://bit.ly/2E53Ov6  #alvascience #BMF https://bit.ly/2SqUydF 

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Come and work @UniofNewcastle! Deadline extended for our exciting inter-disciplinary Ph.D. position in computer-aided drug design. Contact me with any questions. https://www.ncl.ac.uk/postgraduate/funding/sources/ukeustudents/nes011.html …
#chemjobs #compchem #QSAR #MachineLearning #cheminformatics #DrugDiscovery @MattForshaw

Come and work @UniofNewcastle! Deadline extended for our exciting inter-disciplinary Ph.D. position in computer-aided drug design. Contact me with any questions. https://www.ncl.ac.uk/postgraduate/funding/sources/ukeustudents/nes011.html … #chemjobs #compchem #QSAR #MachineLearning #cheminformatics #DrugDiscovery @MattForshaw

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Look at our free #KNIME node based on NCI/NIH Chemical Identifier Resolver @theNCI @knime https://bit.ly/2BmPRXD  #cheminformatics #QSAR

We’re thrilled to announce the signing of frosh pitcher Jack Baird of @PeppBaseball. Welcome to the Knights, Jack. To check out the team’s latest transactions, visit: https://corvallisknights.com/team/transactions … #Qsar #Garz #EDK #SummerKnights

We’re thrilled to announce the signing of frosh pitcher Jack Baird of @PeppBaseball. Welcome to the Knights, Jack. To check out the team’s latest transactions, visit: https://corvallisknights.com/team/transactions … #Qsar #Garz #EDK #SummerKnights

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Replying to @darootwitt @serotonin_ir

چقدر سخته اين درس... #qsar

See the new features of Forge V10.6 in action http://bit.ly/2RrM5RZ  #CompChem #CADD #MoleculeDesign #QSAR

Forge V10.6 now released

Choose the molecules to make, and understand why you should make them

http://bit.ly/2RruOs1 

#CompChem #CADD #MoleculeDesign #QSAR

Forge V10.6 now released Choose the molecules to make, and understand why you should make them http://bit.ly/2RruOs1  #CompChem #CADD #MoleculeDesign #QSAR

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MPOs are the gateway drug to machine learning #qsar

JCIM
22 days ago
Random Forest:  A Classification and Regression Tool for #Compound Classification and #QSAR Modeling
https://pubs.acs.org/doi/abs/10.1021/ci034160g …
@merckgroup
#Most_read_Year

Random Forest:  A Classification and Regression Tool for #Compound Classification and #QSAR Modeling https://pubs.acs.org/doi/abs/10.1021/ci034160g … @merckgroup #Most_read_Year

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Available in Regulatory #Toxicology and #Pharmacology now, this open access, collaborative paper discusses (Q)SAR out of domain and indeterminate results in the content of ICH M7 - read it now: http://bit.ly/2CLQKtP  #ICHM7 #QSAR

Available in Regulatory #Toxicology and #Pharmacology now, this open access, collaborative paper discusses (Q)SAR out of domain and indeterminate results in the content of ICH M7 - read it now: http://bit.ly/2CLQKtP  #ICHM7 #QSAR

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More lights standing by @MatthewsGrip @kinoflo #QSar #griptruck @CityofAtlanta

More lights standing by @MatthewsGrip @kinoflo #QSar #griptruck @CityofAtlanta

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#qsar for #catalyst selectivity (with descriptor code at https://gitlab.com/SEDenmarkLab/ccheminfolib …) http://science.sciencemag.org/content/363/6424/eaau5631 … #compchem

Comment on '#AI in Drug Discovery - A Practical View From the Trenches' (with #albatross photos from #NZ #SouthIsland) cc @wpwalters #MachineLearning #QSAR #cheminformatics #CompChem #DrugDesign #DrugDiscovery http://fbdd-lit.blogspot.com/2019/01/thoughts-on-ai-in-drug-discovery.html …

Registration is now open for our next #UKQSAR & #Chemoinformatics meeting hosted by Astex Pharma in Cambridge @DowningConf on Thursday 4th April: http://ukqsar.org/index.php/2019/01/10/ukqsar-spring-2019-cambridge/ … #Cheminformatics #QSAR #AI #ML #ArtificialIntelligence #MachineLearning #CompChem #RealTimeChem #DrugDiscovery

Just published on computational methods for ID'ing endocrine disrupting chemicals! https://www.tandfonline.com/doi/full/10.1080/10590501.2018.1537132 … #ComputationalToxicology #QSAR #EDCs #ERbinding #ARbinding

Available in Regulatory #Toxicology and #Pharmacology now, this open access, collaborative paper discusses (Q)SAR out of domain and indeterminate results in the content of ICH M7 - read it now: http://bit.ly/2CLQKtP  #ICHM7 #QSAR

Available in Regulatory #Toxicology and #Pharmacology now, this open access, collaborative paper discusses (Q)SAR out of domain and indeterminate results in the content of ICH M7 - read it now: http://bit.ly/2CLQKtP  #ICHM7 #QSAR

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