Showing posts with label ML. Show all posts
Showing posts with label ML. Show all posts

Monday, 1 May 2023

Just learned about #PROTACs, a promising new class of drugs that target #protein degradation! Exciting times in the world of drug discovery. ๐Ÿงช๐Ÿ’Š https://t.co/kc3jsYoms5


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May 01, 2023 at 04:00AM

Saturday, 1 April 2023

Don't be afraid to take risks and make mistakes. Learn it, Try it, Train it and Deploy it That's how we grow and learn in computational chemistry! #motivation #research #compchem #chemistry https://t.co/vEtB0medFR


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April 01, 2023 at 04:00AM

Friday, 31 March 2023

Species translation in protein structures refers to the process of aligning the amino acid sequences of two proteins from different species before performing molecular docking studies. https://t.co/4xUyVba2yC


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March 31, 2023 at 02:00AM

Monday, 27 March 2023

Insulin is a protein that is easily broken down by digestive enzymes in the stomach before it can be absorbed into the bloodstream. This makes it difficult for insulin to be absorbed effectively if it is taken orally, which is why it must be injected. #informative #researchideas https://t.co/gCkhm7LbU3


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March 27, 2023 at 07:00AM

Saturday, 25 March 2023

Tautomers are different forms of a compound that exist in equilibrium with each other. They can affect the binding of a compound to a protein target because different tautomers have different chemical properties that can affect how well they interact with the protein. #medchem https://t.co/4c5bwIvA0S


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March 25, 2023 at 03:00AM

Wednesday, 15 March 2023

#UKQSAR interesting talks #data #ml #ai #compchem #drugdiscovery #cheminformatics #qsar #API https://t.co/IKGuskyrMV


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March 15, 2023 at 06:03AM

Tuesday, 14 March 2023

RT @NilsWeskamp: PostDoc opportunity at the interface of academia (Val Gillet, Sheffield) and industry: de novo design, chemical synthesis & evolutionary optimization. Please take a look or share: https://t.co/j9OqzAP5kA


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March 14, 2023 at 06:57AM

Thursday, 9 March 2023

RT @MatthiasRarey: This years program of GRC Computer-Aided Drug Design Conference (Mt.Snow, July 16-21/23) just published: https://t.co/42NoAVXnnH


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March 09, 2023 at 09:55PM

Saturday, 4 March 2023

Came across an interesting paper on Do's and Don'ts in generating #MachineLearning models & #data handling https://t.co/B9Wnh9N6X1 >Data >Models >Results>Visualization>Analysis >Deploy #ML #AI #Generative #Statistics #ArtificialIntelligence #DataScience #DataAnalytics #QSAR


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March 04, 2023 at 04:47PM

Thursday, 2 March 2023

Future drug discovery would employ a lot of the following technologies: #AI & #ML #CRISPR gene editing #Quantum computing #Nanomedicine 3D printing VR & AR Synthetic biology Precision medicine Human #organoids #Blockchain technology #thread #drugdiscovery #genomics #pharma https://t.co/ghRo2VTS5X


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March 02, 2023 at 12:00AM

Monday, 20 February 2023

Insights on molecular dynamics Advancements in visualization techniques, allowing for the interactive exploration and analysis of molecular simulations. 1/6 #compchem #MD #biophysics #drugdiscovery https://t.co/HFLJsoX4V7


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February 20, 2023 at 12:20AM

Sunday, 19 February 2023

10 steps to progress.... https://t.co/OAQNowGsja


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February 19, 2023 at 12:21PM

Friday, 17 February 2023

"A discovery in science, or a new theory, even when it appears most unitary and most all-embracing, deals with some immediate element of novelty or paradox within the framework of far vaster, unanalysed, unarticulated reserves of knowledge." - J. Robert Oppenheimer https://t.co/HCvQW2B8CV


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February 17, 2023 at 12:20AM

Monday, 13 February 2023

How can we improve the efficiency and accuracy of drug screening methods? #drugdiscovery #bioscience #pharma #pharmacology #futureofscience #research https://t.co/DK041LMmsO


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February 13, 2023 at 12:20AM

Monday, 6 February 2023

#Bard @Google 's #AI chatbot https://t.co/Cp3AYPLmA9 #ChatGPT Could we expect #ChemGPT? Something like #BioGPT.


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February 06, 2023 at 11:01PM

"The greatest reward in discovering a cure is not in financial gain, but in the healing and alleviation of suffering." - Paul Ehrlich https://t.co/M4NihUrrNP


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February 06, 2023 at 12:20AM

Saturday, 4 February 2023

RT @D_B_McConnell: These were the 10 choices of BRD4 Chemical Matter that the students got for their assignment to design improved BRD4 Inhibitors. Which one would you choose? https://t.co/vYe8QPUVEr


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February 04, 2023 at 12:17PM

Friday, 3 February 2023

How can we improve the success rate of clinical trials and bring new drugs to market more quickly? Unanswered questions! #pharma #drugdiscovery #research #futureofscience https://t.co/xqHLQj6lr6


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February 03, 2023 at 12:00AM

Thursday, 2 February 2023

RT @marcvanderkamp: #Postdoc position to do #compchem on #enzymes in my group @BristolBiochem! Want to explore using #ML potentials for enzyme reactions & simulation-led enzyme engineering? Apply by Feb 19th! https://t.co/wpSHotkCgR DM/email with Qs. (#BlackInSTEMM particularly encouraged)


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February 02, 2023 at 11:19AM

Wednesday, 1 February 2023

How can we better understand the complex mechanisms of drug action at the molecular level? Unanswered questions! #drugdiscovery #pharma #research #futureofbiology ##evolution https://t.co/Jk6Hb5cUpw


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February 01, 2023 at 12:00AM