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"No, 'drug space' scientists alone will not be able to handle exponential data growth" source: Steve's ML blogWhy would people be interested in automating decisions via data science? Clearly, I think this needs to happen to improve...
"Open source chemistry software and molecular databases broaden the research horizons of drug discovery" [DOI 10.1145/2366316.2366334]Here some additional thoughts for putting our recent advocacy article and a call-for-action for more collaboration between...
Some of my science peers contacted me and therefore I would like to add some clarification to the "drug resistance" statement following after 0:44 in the following video. We need to separate a bit more cause and consequence in the mentioned HIV drug resistance...

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After a recent question on Blue Obelisk Exchange and ChemPedia Lab about molecular drug design (see also cross-post) and a recent book about molecular modeling basics I thought it is time highlighting more information on that topic.Drug design principles, molecular...
"No, 'drug space' scientists alone will not be able to handle exponential data growth" source: Steve's ML blogWhy would people be interested in automating decisions via data science? Clearly, I think this needs to happen to improve...
"Open source chemistry software and molecular databases broaden the research horizons of drug discovery" [DOI 10.1145/2366316.2366334]Here some additional thoughts for putting our recent advocacy article and a call-for-action for more collaboration between...

Latest posts linking here

Molecular interactions are an important part of the theoretical framework of modern drug discovery and studying them is a great way to increase your understanding of physicochemical principles of molecular design. One view of molecular design is as a process...