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Application

Discovery Studio 1.0 Materials Studio 0.951625507971241 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0659839527027027 Amorphous Cell 0.27576013513513514 Blends 0.0023226351351351353 CASTEP 0.3840793918918919 CDOCKER 0.17504222972972974 CHARMm 0.27037584459459457 COMPASS 0.3575802364864865 COMPASS III 0.08129222972972973 COSMObase 0.0034839527027027027 COSMOconf 0.004328547297297297 COSMOmic 1.0557432432432433E-4 COSMOperm 0.0013724662162162163 COSMOplex 3.16722972972973E-4 COSMOquick 0.0014780405405405406 COSMOtherm 0.06461148648648649 Cantera 0.0 Catalyst 0.12858952702702703 Classical Simulations 1.0 Conformers 7.390202702702703E-4 Crystallization 0.07295185810810811 DFTB Plus 0.006017736486486487 DMol3 0.17282516891891891 DPD 0.0030616554054054054 Discover 0.0035895270270270272 Forcite 0.5250211148648649 GULP 0.02417652027027027 Kinetix 2.1114864864864866E-4 LUDI 0.004328547297297297 LibDock 0.07390202702702703 LigandFit 0.005595439189189189 MCSS 6.33445945945946E-4 MODELER 0.19098395270270271 MesoDyn 0.001266891891891892 Mesocite 0.003800675675675676 Mesoscale 0.0071790540540540545 Modules 0.0 Morphology 0.01784206081081081 ONETEP 0.0011613175675675676 Polymorph 0.0017947635135135136 QMERA 1.0557432432432433E-4 QSAR 0.0011613175675675676 Quantum Mechanics 0.545924831081081 Reflex 0.052681587837837836 Reflex Plus 8.445945945945946E-4 Semi-empirical 0.008023648648648648 Sorption 0.0551097972972973 Synthia 0.0016891891891891893 TURBOMOLE 5.278716216216217E-4 VAMP 0.0016891891891891893 Visualization 0.8588471283783784 X-Cell 0.0013724662162162163 ZDOCK 0.030405405405405407

Year

2021 0.0 2022 0.10483722641162406 2023 0.36058488136840167 2024 0.6825455214272577 2025 1.0 2026 0.3225124149347066 2027 8.276623137759794E-4

Keywords

target 1.0 potential 0.2695029377707252 docking 0.2170519363554488 visualization 0.19903932752927048 analysis 0.17995453960629584 between 0.14461551657588884 novel 0.10087060942659862 energy 0.0776257666080542 binding 0.07230775828794442 cell 0.058540978685079556 promising 0.05519577990307501 activity 0.055024231247587596 interaction 0.03555345884976627 synthesized 0.03237980872324913 stability 0.032251147231633574 experimental 0.026804477419908223 protein 0.022901745507569585 performance 0.021143371788823605 development 0.020714500150105074 effective 0.019470772397821332 mechanism 0.018312818973281297 synthesis 0.017455075695844233 including 0.017154865548741263 design 0.0023587940129519234 compound 0.0
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