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Application

Discovery Studio 0.8477043673012318 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07027477102414655 Amorphous Cell 0.2925895087427144 Blends 0.002497918401332223 CASTEP 0.3878434637801832 CDOCKER 0.14454621149042465 CHARMm 0.2283097418817652 COMPASS 0.3733555370524563 COMPASS III 0.08975853455453789 COSMObase 0.0033305578684429643 COSMOconf 0.005495420482930891 COSMOmic 0.0 COSMOperm 9.991673605328892E-4 COSMOplex 3.3305578684429644E-4 COSMOquick 6.661115736885929E-4 COSMOtherm 0.06844296419650292 Cantera 0.0 Catalyst 0.10791007493755204 Classical Simulations 1.0 Conformers 6.661115736885929E-4 Crystallization 0.07793505412156536 DFTB Plus 0.006661115736885929 DMol3 0.17418817651956703 DPD 0.002997502081598668 Discover 0.0036636136552872607 Forcite 0.5611990008326395 GULP 0.019816819317235636 Kinetix 3.3305578684429644E-4 LUDI 0.0038301415487094087 LibDock 0.05978351373855121 LigandFit 0.004163197335553705 MCSS 4.995836802664446E-4 MODELER 0.1793505412156536 MesoDyn 4.995836802664446E-4 Mesocite 0.0036636136552872607 Mesoscale 0.00649458784346378 Morphology 0.018984179850124894 ONETEP 0.0013322231473771858 Polymorph 0.0016652789342214821 QMERA 3.3305578684429644E-4 QSAR 9.991673605328892E-4 Quantum Mechanics 0.5533721898417985 Reflex 0.056119900083263945 Reflex Plus 4.995836802664446E-4 Semi-empirical 0.008825978351373855 Sorption 0.058118234804329726 Synthia 0.001498751040799334 TURBOMOLE 6.661115736885929E-4 VAMP 0.001498751040799334 Visualization 0.7340549542048294 X-Cell 0.0013322231473771858 ZDOCK 0.025312239800166527

Year

2022 0.008777239709443099 2023 0.29207021791767557 2024 0.6054782082324455 2025 1.0 2026 0.524364406779661 2027 0.0

Keywords

target 1.0 potential 0.27338517206867347 docking 0.19631996304565402 analysis 0.1909307875894988 visualization 0.1765339902994842 between 0.1552852413580722 energy 0.09523442913234276 novel 0.0905381476634075 cell 0.06697975209792902 promising 0.06082069443375163 binding 0.060743706212949417 activity 0.04449919162368158 performance 0.04211255677881284 stability 0.03780121641388867 experimental 0.031026252983293555 synthesized 0.026483947955962737 interaction 0.02309646624066518 mechanism 0.020940796058203096 effective 0.017553314342905534 including 0.015243667718839017 development 0.014704750173223497 synthesis 0.0036954345985064285 enhanced 0.0018477172992532142 design 0.0016937408576487797 protein 0.0
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