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Application

Discovery Studio 0.9461447910535609 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06993775173928964 Amorphous Cell 0.28853899670450384 Blends 0.0021969974368363236 CASTEP 0.3500549249359209 CDOCKER 0.15928231417063346 CHARMm 0.2596118637861589 COMPASS 0.3467594287806664 COMPASS III 0.09886488465763457 COSMObase 0.004027828634199927 COSMOconf 0.005492493592090809 COSMOperm 3.661662394727206E-4 COSMOquick 0.0010984987184181618 COSMOtherm 0.06334675942878067 Catalyst 0.07762724276821677 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06737458806298059 DFTB Plus 0.0014646649578908824 DMol3 0.15159282314170633 DPD 0.0014646649578908824 Discover 0.005126327352618088 Forcite 0.5313072134749176 GULP 0.019772976931526912 LUDI 0.004027828634199927 LibDock 0.0692054192603442 LigandFit 0.003661662394727206 MCSS 7.323324789454412E-4 MODELER 0.24716221164408642 MesoDyn 0.0010984987184181618 Mesocite 0.0029293299157817647 Mesoscale 0.005492493592090809 Morphology 0.015012815818381545 ONETEP 0.0 Polymorph 0.0010984987184181618 QMERA 0.0 QSAR 7.323324789454412E-4 Quantum Mechanics 0.49139509337239107 Reflex 0.05016477480776273 Reflex Plus 0.0 Semi-empirical 0.0032954961552544857 Sorption 0.049798608568290006 Synthia 3.661662394727206E-4 TURBOMOLE 3.661662394727206E-4 VAMP 0.0010984987184181618 Visualization 0.6861955327718784 X-Cell 0.0021969974368363236 ZDOCK 0.03002563163676309

Year

2023 0.0017426662794074934 2024 0.46209700842288703 2025 1.0 2026 0.6137089747313389 2027 0.0

Keywords

target 1.0 potential 0.2964983283477037 docking 0.2097483723385536 analysis 0.2095724089389407 visualization 0.15748724265352806 between 0.1508006334682386 novel 0.09590005278901989 promising 0.08023931022347351 energy 0.07759985922928031 binding 0.0723209572408939 cell 0.06369875065986275 activity 0.04575048389934894 stability 0.03906387471405948 performance 0.038360021115607955 including 0.01953193735702974 experimental 0.016188632764385008 effective 0.015484779165933486 development 0.012669364772127397 mechanism 0.012669364772127397 enhanced 0.012493401372514517 strong 0.012141474573288756 interaction 0.011437620974837234 synthesized 0.007742389582966743 design 0.004575048389934893 protein 0.0
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