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Application

Discovery Studio 1.0 Materials Studio 0.9674074074074074 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06570247933884298 Amorphous Cell 0.2758953168044077 Blends 0.0024793388429752068 CASTEP 0.35633608815427 CDOCKER 0.17327823691460056 CHARMm 0.2734159779614325 COMPASS 0.35 COMPASS III 0.08388429752066116 COSMObase 0.003581267217630854 COSMOconf 0.004132231404958678 COSMOmic 0.0 COSMOperm 8.264462809917355E-4 COSMOplex 1.377410468319559E-4 COSMOquick 0.0013774104683195593 COSMOtherm 0.0603305785123967 Cantera 0.0 Catalyst 0.11336088154269973 Classical Simulations 1.0 Conformers 9.641873278236915E-4 Crystallization 0.07327823691460054 DFTB Plus 0.004269972451790634 DMol3 0.1652892561983471 DPD 0.002892561983471074 Discover 0.00371900826446281 Forcite 0.5263085399449036 GULP 0.021212121212121213 Kinetix 1.377410468319559E-4 LUDI 0.005371900826446281 LibDock 0.07190082644628099 LigandFit 0.005785123966942148 MCSS 9.641873278236915E-4 MODELER 0.20853994490358127 MesoDyn 9.641873278236915E-4 Mesocite 0.003856749311294766 Mesoscale 0.0070247933884297524 Morphology 0.017079889807162536 ONETEP 9.641873278236915E-4 Polymorph 0.001652892561983471 QMERA 2.754820936639118E-4 QSAR 8.264462809917355E-4 Quantum Mechanics 0.5126721763085399 Reflex 0.05385674931129476 Reflex Plus 5.509641873278236E-4 Semi-empirical 0.006060606060606061 Sorption 0.05358126721763085 Synthia 6.887052341597796E-4 TURBOMOLE 5.509641873278236E-4 VAMP 0.0012396694214876034 Visualization 0.796969696969697 X-Cell 0.0013774104683195593 ZDOCK 0.02933884297520661

Year

2022 0.08679905083052329 2023 0.2611464968152866 2024 0.6223304608467591 2025 1.0 2026 0.5152991132758836 2027 0.0

Keywords

target 1.0 potential 0.2947531822415399 docking 0.23123253647935424 analysis 0.20664389941012107 visualization 0.2001241850357032 between 0.15262340887923007 novel 0.10363241229431853 energy 0.08208630859981372 binding 0.08115492083203973 promising 0.06799130704750078 cell 0.06525923626203042 activity 0.055572803477181 stability 0.040918969264203665 interaction 0.03390251474697299 performance 0.029804408568767465 synthesized 0.02899720583669668 effective 0.02440235951567836 experimental 0.023533064265755976 including 0.02322260167649798 protein 0.0221049363551692 mechanism 0.021980751319466005 development 0.020366345855324434 synthesis 0.01390872399875815 design 0.0050294939459795095 chemical 0.0
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