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Application

Discovery Studio 0.9967964514539182 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06742906462401553 Amorphous Cell 0.27662099471356133 Blends 0.0026971625849606215 CASTEP 0.3922753263566728 CDOCKER 0.17348149746466718 CHARMm 0.2631351817887582 COMPASS 0.36379328945948863 COMPASS III 0.08080699104542022 COSMObase 0.0031287085985543207 COSMOconf 0.003883914122343295 COSMOmic 2.1577300679684973E-4 COSMOperm 8.630920271873989E-4 COSMOplex 2.1577300679684973E-4 COSMOquick 0.001618297550976373 COSMOtherm 0.06214262595749272 Cantera 0.0 Catalyst 0.11101521199697918 Classical Simulations 1.0 Conformers 0.0010788650339842486 Crystallization 0.0759520983924911 DFTB Plus 0.004531233142733844 DMol3 0.17995468766857267 DPD 0.003020822095155896 Discover 0.004639119646132269 Forcite 0.5305858237134534 GULP 0.023950803754450318 Kinetix 2.1577300679684973E-4 LUDI 0.005610098176718092 LibDock 0.06980256769878088 LigandFit 0.0070126227208976155 MCSS 0.0011867515373826735 MODELER 0.20455281044341353 MesoDyn 0.0012946380407810982 Mesocite 0.004099687129140144 Mesoscale 0.007444168734491315 Modules 0.0 Morphology 0.016830294530154277 ONETEP 0.001402524544179523 Polymorph 0.001618297550976373 QMERA 2.1577300679684973E-4 QSAR 0.0011867515373826735 Quantum Mechanics 0.5610098176718092 Reflex 0.056748300787571475 Reflex Plus 6.473190203905491E-4 Semi-empirical 0.006473190203905492 Sorption 0.05545366274679037 Synthia 8.630920271873989E-4 TURBOMOLE 4.3154601359369945E-4 VAMP 0.001510411047577948 Visualization 0.8205847448484195 X-Cell 0.001402524544179523 ZDOCK 0.029668788434566835

Year

2020 0.0 2021 0.1394080996884735 2022 0.1912550066755674 2023 0.278816199376947 2024 0.8169781931464174 2025 1.0 2026 0.4728526924788607 2027 5.562972852692479E-4

Keywords

target 1.0 potential 0.2727016356457981 docking 0.21526602744876858 visualization 0.19886256815190825 analysis 0.18936830231246474 between 0.15313028764805414 novel 0.0995017860500094 energy 0.08389734912577552 binding 0.07191201353637902 cell 0.060396691107351005 promising 0.05541455160744501 activity 0.05156044369242339 interaction 0.035344989659710474 stability 0.03454596728708404 experimental 0.02721376198533559 performance 0.025380710659898477 synthesized 0.02519270539575108 mechanism 0.02039857115999248 effective 0.02035156984395563 development 0.016779469825155106 protein 0.016403459296860313 including 0.01410039481105471 synthesis 0.01165632637713856 design 0.0040891144952058655 chemical 0.0
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