#expectactives Happy 20th Anniversary @biosolveit https://t.co/o1AeV99W3W
Tuesday, 6 July 2021
Friday, 2 July 2021
Key Research Articles
How do you use Molecular Docking 3D info (clefts, interactions, clashes, torsions, unoccupied spaces, ligand atom contributions) for validating bioactive conformations & ideation for analogues or derivatives? (NOT JUST considering dock score & binding energy) #CADD #CompChem https://t.co/t9xu9kC8kH
Thursday, 1 July 2021
giribio/Bioinformatics
Bioinformatics Learning https://ift.tt/3jAftHI giribio July 1, 2021 at 10:59PM
Key Research Articles
Do you use Multi-Parameter Optimisation techniques in your Drug Discovery projects? #MPO: Identifying high-quality compounds/lead molecules with a balance of properties. Ref1: https://t.co/AKgNqLPCCr Ref2: https://t.co/P5H49lEYGk #DrugDiscovery #CompChem #MedChem #Chemistry https://t.co/8hMaRHgrqC
Key Research Articles
Do you use Multi-Parameter Optimisation techniques in your Drug Discovery projects? #MPO: Identifying high-quality compounds/lead molecules with a balance of properties. Ref1: https://t.co/AKgNqLPCCr Ref2: https://t.co/P5H49lEYGk #DrugDiscovery #CompChem #MedChem #Chemistry https://t.co/8hMaRHgrqC
Key Research Articles
Do you use Multi-Parameter Optimisation techniques in your Drug Discovery projects? #MPO: Identifying high-quality compounds/lead molecules with a balance of properties. Ref1: https://t.co/AKgNqLPCCr Ref2: https://t.co/P5H49lEYGk #DrugDiscovery #CompChem #MedChem #Chemistry https://t.co/8hMaRHgrqC
Wednesday, 30 June 2021
Key Research Articles
QSAR/QSPR: Ubiquitous Links between Cause & Effect "New trend is the integration of #QSAR/QSPR with adjacent computational methods such as VS & #MD. Such synergy offers unique opportunities & heralds a new era of #CADD" https://t.co/czd4REo9Dn #ML #DrugDiscovery #SAR #CompChem https://t.co/Ly5ygzmfvZ
Key Research Articles
QSAR/QSPR: Ubiquitous Links between Cause & Effect "New trend is the integration of #QSAR/QSPR with adjacent computational methods such as VS & #MD. Such synergy offers unique opportunities & heralds a new era of #CADD" https://t.co/czd4REo9Dn #ML #DrugDiscovery #SAR #CompChem https://t.co/Ly5ygzmfvZ
Tuesday, 29 June 2021
Key Research Articles
RT @prashbio: Join me “S1E7: Systems #Phenomics - Expert Talk (45min)“ with @giribio. Sat, 3 Jul at 15:00 on @clubhouse! https://t.co/JIT7UGix4e @bioclues @APBioNetorg
Saturday, 26 June 2021
Friday, 25 June 2021
Key Research Articles
Using #KNIME from 2010 for #cheminformatics, #drugdesign, #drugdiscovery, stat, #qsar, #compchem & screening.. 11 years! many improvements, new features & integrations I will be there to share my experience with users & enthusiasts #openaccess #OpenScience #ml #AI #Data https://t.co/smd6TmblsS
Key Research Articles
Some references Enrichment Factor : >https://t.co/tySAeXHNg6 >https://t.co/Q7oncqgNdA Decoys : >https://t.co/8GsoPy71pC >https://t.co/Mz99uallLa Thanks!
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