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Application

Discovery Studio 1.0 Materials Studio 0.9901334881021474 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06735355848120587 Amorphous Cell 0.2774279717611143 Blends 0.0025758443045220377 CASTEP 0.38341919481015074 CDOCKER 0.16933791261209694 CHARMm 0.2604464796794505 COMPASS 0.3619538256058004 COMPASS III 0.08166380461743943 COSMObase 0.0034344590726960505 COSMOconf 0.004006868918145392 COSMOmic 9.540164090822362E-5 COSMOperm 0.0012402213318069072 COSMOplex 1.9080328181644724E-4 COSMOquick 0.0013356229727151307 COSMOtherm 0.06153405838580424 Cantera 0.0 Catalyst 0.12526235451249762 Classical Simulations 1.0 Conformers 8.586147681740126E-4 Crystallization 0.075081091394772 DFTB Plus 0.00553329517267697 DMol3 0.17448960122114102 DPD 0.0026712459454302615 Discover 0.003243655790879603 Forcite 0.5343445907269605 GULP 0.02365960694523946 Kinetix 2.8620492272467084E-4 LUDI 0.0045792787635947334 LibDock 0.07097882083571837 LigandFit 0.005914901736309865 MCSS 8.586147681740126E-4 MODELER 0.18259874069834 MesoDyn 0.0011448196908986834 Mesocite 0.003911467277237168 Mesoscale 0.006868918145392101 Modules 0.0 Morphology 0.01793550849074604 ONETEP 9.540164090822362E-4 Polymorph 0.0018126311772562488 QMERA 1.9080328181644724E-4 QSAR 0.0010494180499904598 Quantum Mechanics 0.5470330089677542 Reflex 0.05476054188132036 Reflex Plus 8.586147681740126E-4 Semi-empirical 0.007441327990841442 Sorption 0.05561915664949437 Synthia 0.0014310246136233543 TURBOMOLE 5.724098454493417E-4 VAMP 0.0015264262545315779 Visualization 0.8419194810150734 X-Cell 0.0012402213318069072 ZDOCK 0.029383705399732875

Year

2021 0.0 2022 0.1412022817025011 2023 0.3697235629662132 2024 0.6967968407196139 2025 1.0 2026 0.37384817902588857 2027 7.898200965335674E-4

Keywords

target 1.0 potential 0.27953950376127346 docking 0.22326586592410955 visualization 0.20909355388387849 analysis 0.19192884751257222 between 0.15252898882008228 novel 0.10273887203358131 energy 0.0851585553385146 binding 0.07364614937035036 cell 0.06338057437346743 promising 0.05656456506379619 activity 0.05390465899172935 interaction 0.037280246041311665 stability 0.03649058642616682 synthesized 0.031046091184905034 experimental 0.028427746145214247 performance 0.02589252317027555 protein 0.02094676031752629 effective 0.020905199285150243 mechanism 0.02007397863762936 development 0.019949295540501226 including 0.016416607788537468 synthesis 0.014006067910726902 design 0.0021196126511782553 chemical 0.0
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