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Application

Discovery Studio 1.0 Materials Studio 0.9841915885094084 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06839792249300838 Amorphous Cell 0.27606871753895323 Blends 0.002796644027167399 CASTEP 0.40846983619656413 CDOCKER 0.1748302037554934 CHARMm 0.2588094286855773 COMPASS 0.3722732720735118 COMPASS III 0.07518977227327207 COSMObase 0.003036356372353176 COSMOconf 0.0035157810627247303 COSMOmic 2.3971234518577707E-4 COSMOperm 0.0013583699560527367 COSMOplex 3.1961646024770274E-4 COSMOquick 0.001518178186176588 COSMOtherm 0.06328405912904514 Cantera 0.0 Catalyst 0.12576907710747104 Classical Simulations 1.0 Conformers 9.588493807431083E-4 Crystallization 0.07566919696364363 DFTB Plus 0.005673192169396724 DMol3 0.18713543747502998 DPD 0.003276068717538953 Discover 0.004554534558529764 Forcite 0.5320015980823012 GULP 0.02652816620055933 Kinetix 2.3971234518577707E-4 LUDI 0.0051937674790251695 LibDock 0.07143427886536156 LigandFit 0.007191370355573312 MCSS 0.0010387534958050339 MODELER 0.18489812225329605 MesoDyn 0.0015980823012385138 Mesocite 0.004474630443467838 Mesoscale 0.008070315621254494 Modules 0.0 Morphology 0.017339192968437875 ONETEP 0.001278465840990811 Polymorph 0.0019176987614862165 QMERA 2.3971234518577707E-4 QSAR 0.001278465840990811 Quantum Mechanics 0.5836196564123053 Reflex 0.056012784658409906 Reflex Plus 7.191370355573312E-4 Semi-empirical 0.007670795045944866 Sorption 0.05489412704754295 Synthia 0.0014382740711146624 TURBOMOLE 4.7942469037155414E-4 VAMP 0.0015980823012385138 Visualization 0.8771074710347583 X-Cell 0.001278465840990811 ZDOCK 0.030683180183779465

Year

2020 0.004638543672326274 2021 0.12646595483983897 2022 0.28820234552774376 2023 0.41440574129179064 2024 0.945650271311045 2025 1.0 2026 0.3720462103973394 2027 0.0

Keywords

target 1.0 potential 0.26387668176593876 docking 0.2147251707119194 visualization 0.21063484551416403 analysis 0.17875735244405383 between 0.15164627138124534 novel 0.09870867419376649 energy 0.08180650395510784 binding 0.06865661550943142 cell 0.057264552768575484 activity 0.050503684673112025 promising 0.04495977283483199 interaction 0.038063687377459264 stability 0.027719559191400175 synthesized 0.027111081062808465 experimental 0.026975863700899196 protein 0.017747278750591577 mechanism 0.017003583260090594 effective 0.016226083429112297 performance 0.01595564870529376 development 0.015651409640997906 synthesis 0.012000540869447638 including 0.00848488945980664 design 3.7184774525049014E-4 chemical 0.0
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