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Application

Discovery Studio 0.956403147916294 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07001839362354384 Amorphous Cell 0.27559779276517476 Antibody 3.0656039239730225E-4 Blends 0.0030656039239730227 CASTEP 0.4348252605763335 CDOCKER 0.17676272225628448 CHARMm 0.25168608215818516 COMPASS 0.38301655426118947 COMPASS III 0.06486817903126917 COSMObase 0.002513795217657879 COSMOconf 0.0030656039239730227 COSMOmic 2.452483139178418E-4 COSMOperm 0.00134886572654813 COSMOplex 4.904966278356836E-4 COSMOquick 0.0017780502759043532 COSMOtherm 0.06670754138565298 Cantera 6.131207847946045E-5 Catalyst 0.12262415695892091 Classical Simulations 1.0 Conformers 0.0015941140404659717 Crystallization 0.07768240343347639 DFTB Plus 0.0061312078479460455 DMol3 0.20367872470876763 DPD 0.0035561005518087063 Discover 0.006560392397302268 Forcite 0.5312078479460454 GULP 0.029981606376456162 Kinetix 1.8393623543838135E-4 LUDI 0.006376456161863887 LibDock 0.069773145309626 LigandFit 0.009993868792152054 MCSS 0.0015941140404659717 MODELER 0.19883507050889024 MesoDyn 0.001900674432863274 Mesocite 0.005027590435315758 Mesoscale 0.008951563458001226 Modules 0.0 Morphology 0.018393623543838136 ONETEP 0.0015328019619865114 Polymorph 0.0020846106683016555 QMERA 4.2918454935622315E-4 QSAR 0.0017780502759043532 Quantum Mechanics 0.6243408951563458 Reflex 0.05702023298589822 Reflex Plus 9.809932556713672E-4 Semi-empirical 0.008767627222562845 Sorption 0.05389331698344574 Synthia 0.0014101778050275905 TURBOMOLE 6.131207847946045E-4 VAMP 0.0020846106683016555 Visualization 0.8428571428571429 X-Cell 0.0011649294911097487 ZDOCK 0.02967504598405886

Year

2018 0.004647232784114913 2019 0.08466413181242079 2020 0.16003379805661175 2021 0.2607520067596113 2022 0.3730460498521335 2023 0.7620616814533164 2024 1.0 2025 0.9663709336713139 2026 0.3591888466413181 2027 0.0

Keywords

target 1.0 potential 0.236634958077998 visualization 0.19609753596061638 docking 0.19381554319120023 analysis 0.16066254711417655 between 0.15263711186892645 novel 0.09394630906899823 energy 0.08289531037665701 binding 0.06056254967821338 cell 0.0566908540806646 activity 0.048639778467218786 interaction 0.03884515781646625 promising 0.03453757595959078 experimental 0.03171713545806518 synthesized 0.025307043409143356 mechanism 0.020102048665418835 stability 0.017255967795697547 protein 0.014563729135150381 development 0.010794595010384348 effective 0.009871541755339606 performance 0.00974333991436117 synthesis 0.008666444450142304 chemical 0.006128047998769262 design 0.0016153431963282993 including 0.0
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