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Application

Discovery Studio 1.0 Materials Studio 0.9683304647160069 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06554446596156711 Amorphous Cell 0.27528675703858185 Blends 0.0020855057351407717 CASTEP 0.35706837479517356 CDOCKER 0.16996871741397288 CHARMm 0.2732012513034411 COMPASS 0.34842842246387606 COMPASS III 0.08476091166393565 COSMObase 0.0038730820795471474 COSMOconf 0.004468940861015939 COSMOmic 0.0 COSMOperm 8.937881722031879E-4 COSMOplex 1.4896469536719798E-4 COSMOquick 0.0014896469536719798 COSMOtherm 0.06018173692834798 Cantera 0.0 Catalyst 0.11440488604200805 Classical Simulations 1.0 Conformers 7.448234768359899E-4 Crystallization 0.072992700729927 DFTB Plus 0.0038730820795471474 DMol3 0.16266944734098018 DPD 0.0022344704305079697 Discover 0.0038730820795471474 Forcite 0.5249515864740056 GULP 0.021152986742142114 Kinetix 1.4896469536719798E-4 LUDI 0.005362729033219127 LibDock 0.07105615969015343 LigandFit 0.005064799642484731 MCSS 7.448234768359899E-4 MODELER 0.21227469089825712 MesoDyn 8.937881722031879E-4 Mesocite 0.0038730820795471474 Mesoscale 0.006405481900789513 Morphology 0.017428869357962163 ONETEP 0.0010427528675703858 Polymorph 0.0016386116490391778 QMERA 1.4896469536719798E-4 QSAR 7.448234768359899E-4 Quantum Mechanics 0.5107999404141218 Reflex 0.053180396246089674 Reflex Plus 5.958587814687919E-4 Semi-empirical 0.005660658423953523 Sorption 0.05437211380902726 Synthia 5.958587814687919E-4 TURBOMOLE 5.958587814687919E-4 VAMP 0.0013406822583047818 Visualization 0.7939818263071652 X-Cell 0.0014896469536719798 ZDOCK 0.028750186205869208

Year

2022 0.05373711340206186 2023 0.2661082474226804 2024 0.5260309278350516 2025 1.0 2026 0.5208762886597939 2027 0.0

Keywords

target 1.0 potential 0.2982123510292524 docking 0.23266522210184182 analysis 0.20645991332611052 visualization 0.19955308775731312 between 0.15188244853737812 novel 0.10197724810400867 energy 0.0832204767063922 binding 0.08132448537378115 promising 0.06893282773564463 cell 0.06453141928494041 activity 0.05539003250270856 stability 0.041102383531960995 interaction 0.0314192849404117 performance 0.030065005417118092 synthesized 0.0276273022751896 including 0.023835319609967497 effective 0.02241332611050921 protein 0.02234561213434453 experimental 0.022007042253521125 mechanism 0.020178764897074757 development 0.019298483206933913 synthesis 0.012865655471289273 design 0.005484832069339112 chemical 0.0
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