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Application

Discovery Studio 1.0 Materials Studio 0.4168464658669198 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05042935206869633 Amorphous Cell 0.10788446526151445 Antibody 3.12256049960968E-4 Blends 7.8064012490242E-4 CASTEP 0.2936768149882904 CDOCKER 0.2563622170179547 CHARMm 0.36830601092896176 COMPASS 0.1718969555035129 COMPASS III 0.03169398907103825 COSMObase 0.001873536299765808 COSMOconf 0.002498048399687744 COSMOperm 9.36768149882904E-4 COSMOquick 6.24512099921936E-4 COSMOtherm 0.053395784543325525 Cantera 0.0 Catalyst 0.21514441842310694 Classical Simulations 0.7295862607338017 Conformers 0.001717408274785324 Crystallization 0.0351288056206089 DFTB Plus 0.003590944574551132 DMol3 0.13692427790788447 DPD 0.001717408274785324 Discover 0.003278688524590164 Forcite 0.24231069476971118 GULP 0.018579234972677595 Kinetix 3.12256049960968E-4 LUDI 0.01014832162373146 LibDock 0.10444964871194379 LigandFit 0.018891491022638564 MCSS 0.002029664324746292 MODELER 0.29149102263856363 MesoDyn 4.68384074941452E-4 Mesocite 6.24512099921936E-4 Mesoscale 0.002654176424668228 Morphology 0.008118657298985168 ONETEP 0.001249024199843872 Polymorph 0.001405152224824356 QMERA 3.12256049960968E-4 QSAR 0.00156128024980484 Quantum Mechanics 0.42170179547228726 Reflex 0.025604996096799375 Reflex Plus 1.56128024980484E-4 Semi-empirical 0.005932864949258392 Sorption 0.029039812646370025 Synthia 1.56128024980484E-4 TURBOMOLE 4.68384074941452E-4 VAMP 0.001717408274785324 Visualization 1.0 X-Cell 6.24512099921936E-4 ZDOCK 0.03185011709601874

Year

2015 0.0 2016 7.295719844357977E-4 2017 0.09897859922178988 2018 0.13813229571984437 2019 0.17777237354085604 2020 0.21108949416342412 2021 0.30520428015564205 2022 0.41877431906614787 2023 0.6906614785992218 2024 1.0 2025 0.958171206225681 2026 0.24294747081712062 2027 4.8638132295719845E-4

Keywords

potential 1.0 target 0.9595069210109497 docking 0.3584463879898079 visualization 0.24123682941946148 analysis 0.21878658494594036 novel 0.1301563253219475 binding 0.12347634460436609 activity 0.09014530679705254 between 0.07527029818882996 promising 0.06741959920115695 protein 0.059913229116452034 drug 0.052613456373527996 vitro 0.03491495076096687 compound 0.029474554094070658 silico 0.029474554094070658 treatment 0.025755801942015013 inhibition 0.025549204600234143 interaction 0.020384271055712416 therapeutic 0.020384271055712416 development 0.01756077405137387 synthesized 0.008195027890641141 including 0.00750637008470491 energy 0.004751738860959989 stability 0.0031678259073066595 effective 0.0
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