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Application

Discovery Studio 1.0 Materials Studio 0.5466724286949006 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07317073170731707 Amorphous Cell 0.1648189209164819 Blends 0.0022172949002217295 CASTEP 0.376940133037694 CDOCKER 0.1736881005173688 CHARMm 0.3318551367331855 COMPASS 0.2269031781226903 COMPASS III 0.050997782705099776 COSMObase 0.0022172949002217295 COSMOconf 0.0029563932002956393 COSMOmic 0.0 COSMOperm 7.390983000739098E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.06060606060606061 Catalyst 0.14855875831485588 Classical Simulations 0.7908351810790836 Conformers 7.390983000739098E-4 Crystallization 0.025129342202512936 DFTB Plus 0.007390983000739098 DMol3 0.1352549889135255 DPD 0.0014781966001478197 Discover 7.390983000739098E-4 Forcite 0.3252032520325203 GULP 0.015521064301552107 Kinetix 0.0 LUDI 0.005173688100517369 LibDock 0.0835181079083518 LigandFit 0.0014781966001478197 MCSS 0.0 MODELER 0.2801182557280118 MesoDyn 0.0 Mesocite 0.0022172949002217295 Mesoscale 0.004434589800443459 Morphology 0.003695491500369549 QMERA 0.0 QSAR 7.390983000739098E-4 Quantum Mechanics 0.5040650406504065 Reflex 0.018477457501847747 Reflex Plus 0.0 Semi-empirical 0.009608277900960829 Sorption 0.028085735402808575 Synthia 7.390983000739098E-4 VAMP 7.390983000739098E-4 Visualization 1.0 X-Cell 0.0014781966001478197 ZDOCK 0.030303030303030304

Year

2022 6.506180871828237E-4 2023 0.41509433962264153 2024 0.7989590110605075 2025 1.0 2026 0.2797657774886142 2027 0.0

Keywords

analysis 1.0 target 0.9353233830845771 potential 0.3843283582089552 docking 0.37904228855721395 visualization 0.23134328358208955 between 0.13899253731343283 binding 0.1296641791044776 novel 0.07898009950248756 activity 0.06747512437810946 promising 0.05721393034825871 protein 0.05690298507462686 interaction 0.05223880597014925 stability 0.05223880597014925 including 0.04446517412935323 energy 0.03824626865671642 silico 0.03140547263681592 experimental 0.010572139303482588 compound 0.009328358208955223 mechanism 0.00808457711442786 therapeutic 0.00404228855721393 cell 0.003420398009950249 drug 0.0012437810945273632 synthesized 9.328358208955224E-4 vitro 3.109452736318408E-4 inhibition 0.0
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