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Application

Discovery Studio 0.8884503396958913 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06931216931216931 Amorphous Cell 0.2831569664902998 Blends 0.0027336860670194004 CASTEP 0.4141093474426808 CDOCKER 0.15776014109347442 CHARMm 0.23932980599647266 COMPASS 0.37742504409171074 COMPASS III 0.0791005291005291 COSMObase 0.0032627865961199296 COSMOconf 0.003703703703703704 COSMOmic 1.763668430335097E-4 COSMOperm 0.0012345679012345679 COSMOplex 3.527336860670194E-4 COSMOquick 0.001675485008818342 COSMOtherm 0.06525573192239859 Cantera 8.818342151675486E-5 Catalyst 0.10396825396825397 Classical Simulations 1.0 Conformers 0.001146384479717813 Crystallization 0.07724867724867725 DFTB Plus 0.00599647266313933 DMol3 0.1917989417989418 DPD 0.002998236331569665 Discover 0.0050264550264550265 Forcite 0.546031746031746 GULP 0.027160493827160494 Kinetix 2.6455026455026457E-4 LUDI 0.004761904761904762 LibDock 0.06472663139329805 LigandFit 0.00582010582010582 MCSS 0.0012345679012345679 MODELER 0.18791887125220458 MesoDyn 0.0019400352733686067 Mesocite 0.003968253968253968 Mesoscale 0.007760141093474427 Modules 0.0 Morphology 0.01798941798941799 ONETEP 0.0012345679012345679 Polymorph 0.0020282186948853615 QMERA 3.527336860670194E-4 QSAR 0.0013227513227513227 Quantum Mechanics 0.5926807760141094 Reflex 0.056878306878306875 Reflex Plus 8.818342151675485E-4 Semi-empirical 0.0082010582010582 Sorption 0.05793650793650794 Synthia 0.0015873015873015873 TURBOMOLE 6.172839506172839E-4 VAMP 0.001675485008818342 Visualization 0.7846560846560846 X-Cell 0.0013227513227513227 ZDOCK 0.026895943562610228

Year

2020 0.0031050390347764373 2021 0.11985450674237047 2022 0.15312278211497515 2023 0.3741128459900639 2024 0.7583392476933996 2025 1.0 2026 0.3771291696238467 2027 0.0

Keywords

target 1.0 potential 0.260458419270732 docking 0.19379694127719188 visualization 0.18616959178114176 analysis 0.17753045102541154 between 0.15608825932988288 novel 0.0939798420049033 energy 0.09102229832276142 cell 0.05954002412733004 binding 0.05794450714091139 promising 0.04833249017395027 activity 0.04105537611394326 interaction 0.032455150406662255 experimental 0.0307428882748959 stability 0.028369070319492547 performance 0.0267735533330739 synthesized 0.02288204848815037 mechanism 0.01607191500953419 effective 0.013814842199478539 development 0.01354243686033389 including 0.009339611627816477 protein 0.006849048527065416 synthesis 0.004630890765459003 design 7.783009689847064E-5 chemical 0.0
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