SimBioChem @SimBioChemNET
An initiative to connect scientists in the field of computational biochemistry/-physics. Tweets by Alexander Kulesza. simbiochem.net Joined February 2015-
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Following86
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SimBioChem retweeted
A while back we released the @PacBio Iso-Seq Alzheimer brain dataset, a matching short read data is now on GEO: ncbi.nlm.nih.gov/geo/query/acc.…
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SimBioChem retweeted
NFGAIL Amyloid Oligomers: The Onset of Beta-Sheet Formation and the Mechanism for Fibril Formation pubs.acs.org/doi/full/10.10…
Structural basis of membrane disruption and cellular toxicity by α-synuclein oligomers science.sciencemag.org/content/358/63…
SimBioChem retweeted
30 years of DFT in computational chemistry: overview and extensive assessment of 200 density functionals tandfonline.com/doi/full/10.10… #compchem
SimBioChem retweeted
Recent advances in accelerated discovery through machine learning and statistical inference arxiv.org/abs/1706.05405 #compchem #preprint
SimBioChem retweeted
Mutantelec- A mutation simulation tool for comparative electrostatic potential profiling of proteins. advancedsciencenews.com/mutantelec-sim…
SimBioChem retweeted
Chemception: Deep Neural Network w Minimal Chemistry Knowledge Matches Expert QSAR/QSPR Models arxiv.org/abs/1706.06689 #compchem #preprint
SimBioChem retweeted
Discovery of EGF Receptor Inhibitors that are Selective for the d746-750/T790M/C797S Mutant through Struct... (Hong) doi.wiley.com/10.1002/anie.2…
SimBioChem retweeted
European scientists tackling some of the challenges we’ll be facing in the next 60yrs horizon-magazine.eu/article/10-bre… #EU60 #ResearchImpactEU #H2020
SimBioChem retweeted
Computational Tool @BiophysJ by @mharrigan52...@vijaypande MSMBuilder: Statistical Models for Biomolecular Dynamics cell.com/biophysj/fullt…
SimBioChem retweeted
Hydrophobic ligand entry & exit pathways of the CB1 #Cannabinoid #Receptor #compchem pubs.acs.org/doi/abs/10.102…
SimBioChem retweeted
Why molecular modeling is hard: A Binding Pose Flip Explained via Enthalpic and Entropic Contributions pubs.acs.org/doi/abs/10.102…
SimBioChem retweeted
Biological structures of the year yearinreview.cenmag.org/biological-str… via @cenmag
SimBioChem retweeted
Switzerland will regain full participation in #Horizon2020 from 1 January after reinstating freedom of movement: rsrch.co/2iaxRIb
SimBioChem retweeted
Bridging microscopic and macroscopic mechanisms of p53-MDM2 binding using MD and kinetic network models biorxiv.org/content/early/… #compchem
SimBioChem retweeted
In print: New structures turn our understanding of chemokine receptor inhibition inside out (£) go.nature.com/2hk7RK5
SimBioChem retweeted
The Mechanism of p53 Rescue by SUSP4 (Han) doi.org/f3tnnq
SimBioChem retweeted
Which drugs got the green light, & which others stalled this year? Check out this year's 'Drugs in the Headlines': go.nature.com/2gP9jD4
SimBioChem retweeted
Markov modeling reveals novel intracellular modulation of the human TREK-2 selectivity filter biorxiv.org/content/early/… #compchem #preprint
SimBioChem retweeted
Registering for your ORCID iD is easy, learn about how this benefits authors in a short 3 min video youtu.be/_xcclfuvtxQ @ORCID_Org
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