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Application

Discovery Studio 1.0 Materials Studio 0.589845826687932 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04813084112149533 Amorphous Cell 0.2336448598130841 Blends 0.002336448598130841 CASTEP 0.27242990654205607 CDOCKER 0.2808411214953271 CHARMm 0.397196261682243 COMPASS 0.3121495327102804 COMPASS III 0.05514018691588785 COSMObase 0.001869158878504673 COSMOconf 0.001869158878504673 COSMOmic 0.0 COSMOperm 0.002336448598130841 COSMOplex 0.0 COSMOquick 0.003738317757009346 COSMOtherm 0.0630841121495327 Catalyst 0.20514018691588784 Classical Simulations 1.0 Conformers 9.345794392523365E-4 Crystallization 0.05654205607476635 DFTB Plus 0.004672897196261682 DMol3 0.1911214953271028 DPD 0.001869158878504673 Discover 0.004205607476635514 Forcite 0.44205607476635517 GULP 0.014485981308411215 LUDI 0.014485981308411215 LibDock 0.11121495327102804 LigandFit 0.017289719626168223 MCSS 0.004672897196261682 MODELER 0.3014018691588785 MesoDyn 0.002803738317757009 Mesocite 0.004205607476635514 Mesoscale 0.008878504672897197 Morphology 0.01588785046728972 ONETEP 9.345794392523365E-4 Polymorph 9.345794392523365E-4 QSAR 0.003738317757009346 Quantum Mechanics 0.4523364485981308 Reflex 0.0397196261682243 Reflex Plus 0.0 Semi-empirical 0.005607476635514018 Sorption 0.03925233644859813 Synthia 9.345794392523365E-4 TURBOMOLE 0.0 VAMP 4.6728971962616824E-4 Visualization 0.9266355140186916 X-Cell 0.0 ZDOCK 0.04953271028037383

Year

2019 0.0 2020 0.11798469387755102 2021 0.2799744897959184 2022 0.28635204081632654 2023 0.6383928571428571 2024 1.0 2025 0.982780612244898 2026 0.24043367346938777

Keywords

development 1.0 target 0.9568050642338485 potential 0.32172779743064606 docking 0.2396201824613666 novel 0.205548315025135 visualization 0.1809718860547384 analysis 0.1483894991621672 between 0.10929063489108173 binding 0.0845280208527276 promising 0.08173524483336436 activity 0.07484639731893503 effective 0.05399366970768944 protein 0.04989759821262335 design 0.04766337739713275 drug 0.042636380562278905 cell 0.040960714950660955 interaction 0.021969838018990877 treatment 0.01787376652392478 including 0.013777695028858686 energy 0.00893688326196239 compound 0.007819772854217092 mechanism 0.003165146155278347 synthesized 0.001861850679575498 stability 0.0011171104077452988 inhibition 0.0
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