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Application

Discovery Studio 0.8645998940116587 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07965738758029979 Amorphous Cell 0.24967880085653105 Blends 0.004282655246252677 CASTEP 0.5918629550321199 CDOCKER 0.1905781584582441 CHARMm 0.23725910064239827 COMPASS 0.4282655246252677 COMPASS III 0.011563169164882228 COSMObase 8.565310492505353E-4 COSMOconf 8.565310492505353E-4 COSMOmic 0.0 COSMOperm 0.001284796573875803 COSMOquick 0.0017130620985010706 COSMOtherm 0.09293361884368308 Catalyst 0.15931477516059958 Classical Simulations 1.0 Conformers 0.0017130620985010706 Crystallization 0.08650963597430407 DFTB Plus 0.008137044967880086 DMol3 0.29978586723768735 DPD 0.007708779443254818 Discover 0.02184154175588865 Forcite 0.48265524625267664 GULP 0.03897216274089936 LUDI 0.008137044967880086 LibDock 0.07708779443254818 LigandFit 0.008993576017130621 MCSS 0.002569593147751606 MODELER 0.0980728051391863 MesoDyn 0.0021413276231263384 Mesocite 0.009421841541755889 Mesoscale 0.01670235546038544 Morphology 0.02184154175588865 ONETEP 0.004282655246252677 Polymorph 0.003426124197002141 QSAR 0.004282655246252677 Quantum Mechanics 0.8788008565310492 Reflex 0.061241970021413274 Reflex Plus 0.0021413276231263384 Semi-empirical 0.013704496788008565 Sorption 0.044967880085653104 Synthia 4.2826552462526765E-4 TURBOMOLE 4.2826552462526765E-4 VAMP 0.005139186295503212 Visualization 0.9927194860813704 X-Cell 4.2826552462526765E-4 ZDOCK 0.038115631691648826

Year

2022 0.0

Keywords

target 1.0 visualization 0.21343215852367267 docking 0.17728029042504917 potential 0.16744819240659506 between 0.16215398578127363 analysis 0.11889275450007564 energy 0.09393435183784601 novel 0.0760853123581909 experimental 0.06716079261836333 interaction 0.05521101194978067 binding 0.052790803206776586 activity 0.052185751021025566 cell 0.04416880955982454 synthesized 0.03131145061261534 well 0.031160187566177583 synthesis 0.024958402662229616 mechanism 0.02450461352291635 chemical 0.02359703524428982 surface 0.018454091665406142 protein 0.016185145968839812 higher 0.010739676297080622 design 0.008924519739827561 promising 0.008319467554076539 stability 0.005596732718196945 compound 0.0
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