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Application

Discovery Studio 1.0 Materials Studio 0.9757844474761255 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06338774644901421 Amorphous Cell 0.27581089675641296 Blends 0.0016959932160271359 CASTEP 0.3281746873012508 CDOCKER 0.1695993216027136 CHARMm 0.27475090099639604 COMPASS 0.33941064235743057 COMPASS III 0.10112359550561797 COSMObase 0.004875980496078016 COSMOconf 0.005935976256094976 COSMOmic 0.0 COSMOperm 4.2399830400678397E-4 COSMOplex 2.1199915200339198E-4 COSMOquick 0.0012719949120203519 COSMOtherm 0.06381174475302098 Catalyst 0.08395166419334323 Classical Simulations 1.0 Conformers 2.1199915200339198E-4 Crystallization 0.07017171931312274 DFTB Plus 0.004027983888064448 DMol3 0.15030739877040492 DPD 0.0019079923680305278 Discover 0.004027983888064448 Forcite 0.5223659105363578 GULP 0.01907992368030528 Kinetix 0.0 LUDI 0.00423998304006784 LibDock 0.07271570913716345 LigandFit 0.0038159847360610556 MCSS 6.359974560101759E-4 MODELER 0.2616069535721857 MesoDyn 6.359974560101759E-4 Mesocite 0.0031799872800508796 Mesoscale 0.005511977952088192 Morphology 0.0158999364002544 ONETEP 6.359974560101759E-4 Polymorph 0.0019079923680305278 QMERA 2.1199915200339198E-4 QSAR 6.359974560101759E-4 Quantum Mechanics 0.4702141191435234 Reflex 0.05130379478482086 Reflex Plus 4.2399830400678397E-4 Semi-empirical 0.005511977952088192 Sorption 0.05384778460886156 Synthia 8.479966080135679E-4 TURBOMOLE 2.1199915200339198E-4 VAMP 8.479966080135679E-4 Visualization 0.7191011235955056 X-Cell 0.0016959932160271359 ZDOCK 0.029255882976468094

Year

2023 0.0010263427984946972 2024 0.4365378036264112 2025 1.0 2026 0.6987683886418063 2027 0.0

Keywords

target 1.0 potential 0.3100458949515553 docking 0.22631310555838857 analysis 0.2193778684344722 visualization 0.16991330953595105 between 0.14737378888322283 novel 0.09403365629780724 promising 0.08291687914329424 binding 0.07781744008159103 energy 0.0736359000509944 cell 0.05894951555328914 activity 0.04752677205507394 stability 0.0393676695563488 performance 0.032738398776134624 including 0.023865374808771034 effective 0.016420193778684346 synthesized 0.012646608873023968 development 0.012442631310555839 interaction 0.010912799592044876 mechanism 0.010810810810810811 strong 0.010198878123406425 experimental 0.009484956654767975 enhanced 0.006731259561448241 protein 0.006527281998980112 design 0.0
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