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Application

Discovery Studio 1.0 Materials Studio 0.7939882697947214 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05776780706674145 Amorphous Cell 0.14638250140213124 Blends 0.00448681996634885 CASTEP 0.49355019629837354 CDOCKER 0.21031968592260236 CHARMm 0.24565339315759954 COMPASS 0.29837352776219855 COMPASS III 0.002243409983174425 COSMOconf 0.0011217049915872126 COSMOmic 0.0011217049915872126 COSMOperm 5.608524957936063E-4 COSMOquick 0.0016825574873808188 COSMOtherm 0.05888951205832866 Catalyst 0.07571508693213685 Classical Simulations 0.7818283791362871 Conformers 0.0011217049915872126 Crystallization 0.06393718452047112 DFTB Plus 0.005047672462142457 DMol3 0.2226584408300617 DPD 0.005608524957936063 Discover 0.01682557487380819 Forcite 0.3011777902411666 GULP 0.04206393718452047 LUDI 0.010095344924284913 LibDock 0.06842400448681997 LigandFit 0.018508132361189006 MCSS 0.005047672462142457 MODELER 0.27313516545148625 MesoDyn 0.0033651149747616375 Mesocite 0.00448681996634885 Mesoscale 0.012338754907459339 Morphology 0.020190689848569827 ONETEP 0.0028042624789680315 Polymorph 0.0011217049915872126 QMERA 0.0 QSAR 5.608524957936063E-4 Quantum Mechanics 0.6982613572630398 Reflex 0.04094223219293326 Reflex Plus 0.0016825574873808188 Semi-empirical 0.011217049915872126 Sorption 0.03196859226023556 Synthia 5.608524957936063E-4 TURBOMOLE 0.0 VAMP 0.005047672462142457 Visualization 1.0 X-Cell 0.0 ZDOCK 0.034772854739203586

Year

2021 0.0

Keywords

target 1.0 visualization 0.2573231185218567 docking 0.21541234790446148 potential 0.18679585398828302 between 0.15187021180712032 analysis 0.14015322217214962 novel 0.08720144209103199 binding 0.0736818386660658 activity 0.06331680937359171 interaction 0.052050473186119876 energy 0.05137449301487156 experimental 0.04754393871113114 well 0.04258675078864353 protein 0.03785488958990536 synthesized 0.023208652546191977 drug 0.018476791347453808 cell 0.01757548445245606 chemical 0.017124831004957188 mechanism 0.016448850833708877 compound 0.015998197386210004 synthesis 0.014646237043713385 promising 0.007210455159981974 higher 0.00473186119873817 inhibition 0.004281207751239297 development 0.0
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