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Application

Discovery Studio 1.0 Materials Studio 0.978968596946125 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0688536409516943 Amorphous Cell 0.28406633020908434 Blends 0.0021629416005767843 CASTEP 0.3446286950252343 CDOCKER 0.1651045421773612 CHARMm 0.27108868060562363 COMPASS 0.34138428262436915 COMPASS III 0.0973323720259553 COSMObase 0.003965392934390771 COSMOconf 0.005407354001441961 COSMOperm 3.604902667627974E-4 COSMOquick 0.0010814708002883922 COSMOtherm 0.06236481614996395 Catalyst 0.08651766402307137 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06633020908435472 DFTB Plus 0.0014419610670511895 DMol3 0.14924297043979812 DPD 0.0014419610670511895 Discover 0.005046863734679163 Forcite 0.523071377072819 GULP 0.01946647440519106 LUDI 0.004325883201153569 LibDock 0.07317952415284787 LigandFit 0.003604902667627974 MCSS 0.0010814708002883922 MODELER 0.25919250180245135 MesoDyn 0.0010814708002883922 Mesocite 0.002883922134102379 Mesoscale 0.005407354001441961 Morphology 0.014780100937274693 ONETEP 0.0 Polymorph 0.0010814708002883922 QMERA 0.0 QSAR 7.209805335255948E-4 Quantum Mechanics 0.4837779379956741 Reflex 0.04938716654650324 Reflex Plus 0.0 Semi-empirical 0.0032444124008651765 Sorption 0.049026676279740444 Synthia 3.604902667627974E-4 TURBOMOLE 3.604902667627974E-4 VAMP 0.0010814708002883922 Visualization 0.726027397260274 X-Cell 0.0021629416005767843 ZDOCK 0.03208363374188897

Year

2023 0.004059147579008408 2024 0.5314583937373152 2025 1.0 2026 0.6126413453174834 2027 0.0

Keywords

target 1.0 potential 0.29920190185090845 docking 0.22210901681100356 analysis 0.2109016811003566 visualization 0.1672609950755646 between 0.14603498047206656 novel 0.09407369672270334 binding 0.07641365257259297 promising 0.07573442010528103 energy 0.06979113601630157 cell 0.058753608422482596 activity 0.04771608082866361 stability 0.03565970453387672 performance 0.029037187977585328 including 0.018848700967906265 interaction 0.014263881813550688 effective 0.012905416878926813 mechanism 0.01239599252844286 experimental 0.011716760061130923 development 0.010528103243335031 strong 0.007301749023603328 synthesized 0.007131940906775344 protein 0.006113092205807438 enhanced 0.005773475972151469 design 0.0
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