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Application

Discovery Studio 0.9087688219663419 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.069578596461236 Amorphous Cell 0.2844687580135054 Blends 0.0025643217369005896 CASTEP 0.40977861355671424 CDOCKER 0.15975724420890675 CHARMm 0.24284126848448587 COMPASS 0.37541670228224633 COMPASS III 0.07863919993161808 COSMObase 0.003248140866740747 COSMOconf 0.0036755278228908454 COSMOmic 2.56432173690059E-4 COSMOperm 0.0014531156509103341 COSMOplex 3.4190956492007865E-4 COSMOquick 0.0013676382596803146 COSMOtherm 0.06444995298743482 Cantera 0.0 Catalyst 0.11753141294127703 Classical Simulations 1.0 Conformers 0.001025728694760236 Crystallization 0.07633131036840755 DFTB Plus 0.005897939994871357 DMol3 0.18531498418668263 DPD 0.0031626634755107276 Discover 0.004188392170270963 Forcite 0.5444909821352253 GULP 0.026668946063766134 Kinetix 2.56432173690059E-4 LUDI 0.004273869561500983 LibDock 0.06667236515941534 LigandFit 0.005812462603641337 MCSS 7.69296521070177E-4 MODELER 0.1665099581160783 MesoDyn 0.0016240704333703735 Mesocite 0.004273869561500983 Mesoscale 0.007949397384391828 Modules 0.0 Morphology 0.01760834259338405 ONETEP 0.001025728694760236 Polymorph 0.001965979998290452 QMERA 2.56432173690059E-4 QSAR 0.0011112060859902555 Quantum Mechanics 0.5833831951448841 Reflex 0.056329600820582956 Reflex Plus 7.69296521070177E-4 Semi-empirical 0.008034874775621849 Sorption 0.056244123429352935 Synthia 0.0014531156509103341 TURBOMOLE 5.983417386101376E-4 VAMP 0.0017095478246003932 Visualization 0.800239336695444 X-Cell 0.0012821608684502948 ZDOCK 0.02803658432344645

Year

2021 0.0 2022 0.19478017165878436 2023 0.37572254335260113 2024 0.9013837799964968 2025 1.0 2026 0.37300753196706954 2027 7.006480994920302E-4

Keywords

target 1.0 potential 0.2654362667867057 docking 0.20087778528021608 visualization 0.19206242028659315 analysis 0.18133393352839672 between 0.1551504238877635 novel 0.09674394178107885 energy 0.091604771550754 cell 0.06279540850776502 binding 0.061745067146822714 promising 0.049065946432590594 activity 0.04478955660589692 interaction 0.03571160627203841 stability 0.034023557656238275 experimental 0.031510240828269184 performance 0.027683997299122215 synthesized 0.02723385100157551 mechanism 0.018793607922574836 effective 0.018193412859179234 development 0.015455022882436793 including 0.012341510991072098 protein 0.010465901417960837 synthesis 0.00919048690824518 chemical 7.502438292445044E-5 design 0.0
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