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Application

Discovery Studio 1.0 Materials Studio 0.9758376718729141 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06750406651003073 Amorphous Cell 0.273721308512561 Blends 0.0026206397975781673 CASTEP 0.4012289896981746 CDOCKER 0.1744080968733056 CHARMm 0.26350984999096333 COMPASS 0.36336526296764865 COMPASS III 0.07879992770648835 COSMObase 0.003253208024579794 COSMOconf 0.0038857762515814207 COSMOmic 2.7110066871498283E-4 COSMOperm 0.001355503343574914 COSMOplex 2.7110066871498283E-4 COSMOquick 0.001626604012289897 COSMOtherm 0.06217242002530273 Cantera 0.0 Catalyst 0.12506777516717874 Classical Simulations 1.0 Conformers 9.940357852882703E-4 Crystallization 0.07500451834447858 DFTB Plus 0.005602747153442979 DMol3 0.18172781492861015 DPD 0.0026206397975781673 Discover 0.003976143141153081 Forcite 0.5313573106813664 GULP 0.02485089463220676 Kinetix 2.7110066871498283E-4 LUDI 0.005150912705584674 LibDock 0.07211277787818543 LigandFit 0.0067775167178745705 MCSS 9.036688957166094E-4 MODELER 0.19049340321706126 MesoDyn 0.0012651364540032532 Mesocite 0.0036146755828664378 Mesoscale 0.006867883607446231 Modules 0.0 Morphology 0.01707934212904392 ONETEP 0.0012651364540032532 Polymorph 0.0018977046810048797 QMERA 1.807337791433219E-4 QSAR 0.0012651364540032532 Quantum Mechanics 0.5711187420928971 Reflex 0.05539490330742816 Reflex Plus 8.133020061449485E-4 Semi-empirical 0.007319718055304536 Sorption 0.055756370865714805 Synthia 0.001445870233146575 TURBOMOLE 5.422013374299657E-4 VAMP 0.001355503343574914 Visualization 0.8685161756732334 X-Cell 0.0012651364540032532 ZDOCK 0.030092174227363093

Year

2021 0.07789807235278584 2022 0.17384033095678197 2023 0.36933368541501627 2024 0.7920957662177626 2025 1.0 2026 0.3741748085555849 2027 0.0

Keywords

target 1.0 potential 0.27360055553412294 docking 0.22167354654527216 visualization 0.21137301801628022 analysis 0.1884186566876278 between 0.15230893869835269 novel 0.10103776860460631 energy 0.0831758034026465 binding 0.07353111376875893 cell 0.05809961035453879 activity 0.054280313259519306 promising 0.05238995409127734 interaction 0.038617337294085875 stability 0.03186605455036457 synthesized 0.028895490143127193 experimental 0.02719802476756298 performance 0.020793950850661626 mechanism 0.01901932795802631 effective 0.01890359168241966 protein 0.018710697889741907 development 0.017167547548319895 synthesis 0.014081246865475868 including 0.012460939006982755 design 6.558388951043555E-4 chemical 0.0
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