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Application

Discovery Studio 1.0 Materials Studio 0.733827052929645 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.10758817242607767 Amorphous Cell 0.1257570359814749 Antibody 0.0 Blends 7.125044531528322E-4 CASTEP 0.3740648379052369 CDOCKER 0.24438902743142144 CHARMm 0.29604560028500176 COMPASS 0.28001425008906305 COMPASS III 0.034556465977912364 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 3.562522265764161E-4 COSMOquick 7.125044531528322E-4 COSMOtherm 0.025293908086925544 Catalyst 0.2946205913786961 Classical Simulations 0.8681866761667261 Conformers 0.0017812611328820805 Crystallization 0.12433202707516922 DFTB Plus 0.0057000356252226575 DMol3 0.16423227645172783 DPD 0.003206270039187745 Discover 0.006768792304951906 Forcite 0.37976487353045957 GULP 0.013893836836480229 LUDI 0.008906305664410403 LibDock 0.06697541859636623 LigandFit 0.020306376914855716 MCSS 0.003206270039187745 MODELER 0.13858211613822585 MesoDyn 0.0017812611328820805 Mesocite 0.0017812611328820805 Mesoscale 0.006768792304951906 Morphology 0.016743854649091557 Polymorph 0.0021375133594584966 QMERA 0.0 QSAR 0.0014250089063056644 Quantum Mechanics 0.5293908086925543 Reflex 0.10438190238688992 Reflex Plus 0.003918774492340577 Semi-empirical 0.00997506234413965 Sorption 0.0399002493765586 Synthia 0.0017812611328820805 TURBOMOLE 0.0 VAMP 0.003562522265764161 Visualization 1.0 X-Cell 0.003206270039187745 ZDOCK 0.005343783398646241

Year

2010 0.0030120481927710845 2011 0.024096385542168676 2012 0.030120481927710843 2013 0.03433734939759036 2014 0.03975903614457831 2015 0.0572289156626506 2016 0.06265060240963856 2017 0.0855421686746988 2018 0.11385542168674699 2019 0.24036144578313254 2020 0.29397590361445786 2021 0.34759036144578315 2022 0.5590361445783133 2023 0.7186746987951808 2024 1.0 2025 0.983132530120482 2026 0.31987951807228915 2027 0.0

Keywords

synthesized 1.0 target 0.9659350057012542 synthesis 0.3561858608893957 docking 0.318557582668187 novel 0.2594070695553022 potential 0.23916761687571267 visualization 0.234036488027366 compound 0.18614595210946408 activity 0.1402508551881414 analysis 0.1338369441277081 binding 0.09350057012542759 designed 0.08352337514253136 design 0.07967502850627138 between 0.07924743443557583 promising 0.07725199543899658 potent 0.06912770809578107 inhibition 0.06684720638540478 vitro 0.06328392246294184 experimental 0.03634549600912201 active 0.023375142531356898 cell 0.019954389965792473 well 0.008124287343215507 effective 0.00798175598631699 energy 0.007126567844925884 drug 0.0
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