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Application

Discovery Studio 1.0 Materials Studio 0.9898977604673808 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06366292480393665 Amorphous Cell 0.2771028755958788 Blends 0.001999077348915885 CASTEP 0.35383669075811164 CDOCKER 0.16792249730893433 CHARMm 0.2720282946332462 COMPASS 0.34184222666461633 COMPASS III 0.09503306166384745 COSMObase 0.004305705059203444 COSMOconf 0.005228356143318468 COSMOmic 0.0 COSMOperm 6.151007227433493E-4 COSMOplex 1.5377518068583732E-4 COSMOquick 0.001537751806858373 COSMOtherm 0.06350914962325081 Cantera 0.0 Catalyst 0.09918499154236506 Classical Simulations 1.0 Conformers 7.688759034291865E-4 Crystallization 0.07150545901891435 DFTB Plus 0.004151929878517607 DMol3 0.15977241273258497 DPD 0.0023066277102875596 Discover 0.003690604336460095 Forcite 0.5251422420421344 GULP 0.01999077348915885 Kinetix 1.5377518068583732E-4 LUDI 0.004305705059203444 LibDock 0.07073658311548515 LigandFit 0.004151929878517607 MCSS 6.151007227433493E-4 MODELER 0.22927879440258342 MesoDyn 7.688759034291865E-4 Mesocite 0.0033830539750884206 Mesoscale 0.005997232046747655 Modules 0.0 Morphology 0.016453944333384592 ONETEP 0.001076426264800861 Polymorph 0.0016915269875442103 QMERA 1.5377518068583732E-4 QSAR 7.688759034291865E-4 Quantum Mechanics 0.5033061663847455 Reflex 0.05228356143318468 Reflex Plus 7.688759034291865E-4 Semi-empirical 0.00568968168537598 Sorption 0.054590189143472245 Synthia 9.226510841150238E-4 TURBOMOLE 3.0755036137167463E-4 VAMP 0.001076426264800861 Visualization 0.7624173458403813 X-Cell 0.0016915269875442103 ZDOCK 0.02798708288482239

Year

2022 0.0 2023 0.15813397129186602 2024 0.4450956937799043 2025 1.0 2026 0.5077751196172249 2027 0.0011961722488038277

Keywords

target 1.0 potential 0.29869667402606653 docking 0.2255537354889253 analysis 0.20817605583647888 visualization 0.18403247631935046 between 0.15013175699736486 novel 0.09678797806424044 energy 0.07812833843743323 promising 0.07278683854426322 binding 0.07157609856847803 cell 0.059468698810626025 activity 0.04871447902571042 stability 0.04031051919378962 performance 0.032262659354746814 synthesized 0.021864539562709208 including 0.020368919592621607 interaction 0.02029769959404601 experimental 0.019229399615412007 effective 0.016309379673812407 development 0.014813759703724805 mechanism 0.014457659710846806 protein 0.011608859767822804 synthesis 0.004486859910262802 enhanced 0.0017804999643900006 design 0.0
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