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Application

Discovery Studio 1.0 Materials Studio 0.687374749498998 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04742268041237113 Amorphous Cell 0.15360824742268042 Blends 0.0036082474226804126 CASTEP 0.38144329896907214 CDOCKER 0.21185567010309278 CHARMm 0.25103092783505154 COMPASS 0.2829896907216495 COMPASS III 0.003092783505154639 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 5.154639175257732E-4 COSMOplex 0.0 COSMOquick 0.0010309278350515464 COSMOtherm 0.05309278350515464 Catalyst 0.0731958762886598 Classical Simulations 0.765979381443299 Conformers 5.154639175257732E-4 Crystallization 0.05824742268041237 DFTB Plus 0.0036082474226804126 DMol3 0.17989690721649484 DPD 0.006185567010309278 Discover 0.01134020618556701 Forcite 0.2979381443298969 GULP 0.03917525773195876 LUDI 0.009278350515463918 LibDock 0.07164948453608247 LigandFit 0.017010309278350514 MCSS 0.004639175257731959 MODELER 0.27989690721649485 MesoDyn 0.002577319587628866 Mesocite 0.007216494845360825 Mesoscale 0.011855670103092783 Morphology 0.01752577319587629 ONETEP 0.002061855670103093 Polymorph 0.0015463917525773195 QMERA 0.0010309278350515464 QSAR 0.002061855670103093 Quantum Mechanics 0.5463917525773195 Reflex 0.03762886597938144 Reflex Plus 0.002061855670103093 Semi-empirical 0.009278350515463918 Sorption 0.027835051546391754 Synthia 5.154639175257732E-4 VAMP 0.0036082474226804126 Visualization 1.0 X-Cell 0.0 ZDOCK 0.034536082474226806

Year

2021 0.0

Keywords

target 1.0 visualization 0.2718954248366013 docking 0.234640522875817 potential 0.19150326797385622 between 0.14923747276688454 analysis 0.14183006535947712 novel 0.09389978213507626 binding 0.0803921568627451 activity 0.07058823529411765 interaction 0.04967320261437908 protein 0.04400871459694989 experimental 0.03442265795206972 well 0.03442265795206972 synthesized 0.025272331154684097 energy 0.024618736383442266 cell 0.024400871459694988 drug 0.021568627450980392 synthesis 0.015032679738562092 mechanism 0.013507625272331155 compound 0.010893246187363835 chemical 0.008278867102396514 inhibition 0.00392156862745098 development 0.002832244008714597 design 4.3572984749455336E-4 active 0.0
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