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Application

Discovery Studio 1.0 Materials Studio 0.9732774214767308 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06398051804294887 Amorphous Cell 0.2792782820456055 Blends 0.002656630506973655 CASTEP 0.3961700243524463 CDOCKER 0.1772193934027009 CHARMm 0.2599070179322559 COMPASS 0.3662829311489927 COMPASS III 0.08290901040513615 COSMObase 0.0036528669470887757 COSMOconf 0.003984945760460483 COSMOmic 1.1069293779056896E-4 COSMOperm 0.0012176223156962586 COSMOplex 3.320788133717069E-4 COSMOquick 0.0011069293779056896 COSMOtherm 0.06619437679876024 Cantera 0.0 Catalyst 0.11135709541731238 Classical Simulations 1.0 Conformers 9.962364401151207E-4 Crystallization 0.0744963471330529 DFTB Plus 0.006309497454062431 DMol3 0.18242196147885764 DPD 0.002767323444764224 Discover 0.005091875138366172 Forcite 0.5302191720168253 GULP 0.025348682754040293 Kinetix 2.2138587558113792E-4 LUDI 0.004981182200575604 LibDock 0.0723931813150321 LigandFit 0.006752269205224707 MCSS 0.0011069293779056896 MODELER 0.2107593535532433 MesoDyn 0.0016603940668585345 Mesocite 0.003763559884879345 Mesoscale 0.0073057338941775515 Modules 0.0 Morphology 0.017932255922072173 ONETEP 7.748505645339827E-4 Polymorph 0.002213858755811379 QMERA 2.2138587558113792E-4 QSAR 0.0013283152534868275 Quantum Mechanics 0.5661943767987603 Reflex 0.053907460704007086 Reflex Plus 7.748505645339827E-4 Semi-empirical 0.00841266327208324 Sorption 0.05523577595749391 Synthia 0.0017710870046491033 TURBOMOLE 3.320788133717069E-4 VAMP 0.0016603940668585345 Visualization 0.859530661943768 X-Cell 9.962364401151207E-4 ZDOCK 0.03077263670577817

Year

2020 0.027600337471375195 2021 0.17934193081836808 2022 0.2088706761480053 2023 0.3486802458720019 2024 0.8360853320477281 2025 1.0 2026 0.5051223333735085 2027 0.0

Keywords

target 1.0 potential 0.26875742456640533 docking 0.218104062722737 visualization 0.20679496317415064 analysis 0.1855072463768116 between 0.15034449988120693 novel 0.09893086243763365 energy 0.08035162746495604 binding 0.07023045854122119 cell 0.05915894511760513 promising 0.05307674031836541 activity 0.05274411974340699 interaction 0.03292943692088382 synthesized 0.02760750772154906 experimental 0.026847232121644096 stability 0.02622950819672131 development 0.018484200522689474 performance 0.018009028272748872 protein 0.016773580422903302 mechanism 0.01610833927298646 effective 0.014302684723212165 including 0.010121168923734854 synthesis 0.009170824423853648 design 9.028272748871466E-4 chemical 0.0
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