The final meeting of the Computational Biology and Drug Design research group News The final meeting of the Computational Biology and Drug Design research group
MAINFRAME Symposium on AI-Driven Small-Molecule Drug Discovery News MAINFRAME Symposium on AI-Driven Small-Molecule Drug Discovery
Revealing druggable cryptic pockets in the Nsp1 of SARS-CoV-2 and other beta-coronaviruses by simulations and crystallography Publications 2022 Revealing druggable cryptic pockets in the Nsp1 of SARS-CoV-2 and other beta-coronaviruses by simulations and crystallography
Novel indolic AMPK modulators induce vasodilatation through activation of the AMPK-eNOS-NO pathway Publications 2022 Novel indolic AMPK modulators induce vasodilatation through activation of the AMPK-eNOS-NO pathway
From acid activation mechanisms of proton conduction to design of inhibitors of the M2 proton channel of influenza A virus Publications 2022 From acid activation mechanisms of proton conduction to design of inhibitors of the M2 proton channel of influenza A virus
Elucidating the activation mechanism of AMPK by direct pan-activator PF-739 Publications 2022 Elucidating the activation mechanism of AMPK by direct pan-activator PF-739
A fluorogenic probe for granzyme B enables in-biopsy evaluation and screening of response to anticancer immunotherapies Publications 2022 A fluorogenic probe for granzyme B enables in-biopsy evaluation and screening of response to anticancer immunotherapies
Discovery and in vivo proof of concept of a highly potent dual inhibitor of soluble epoxide hydrolase and acetylcholinesterase for the treatment of Alzheimer’s disease Publications 2022 Discovery and in vivo proof of concept of a highly potent dual inhibitor of soluble epoxide hydrolase and acetylcholinesterase for the treatment of Alzheimer’s disease
