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Application

Discovery Studio 0.9472147573073223 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06953106953106954 Amorphous Cell 0.25775005775005777 Antibody 3.234003234003234E-4 Blends 0.003511203511203511 CASTEP 0.4619080619080619 CDOCKER 0.18955878955878955 CHARMm 0.2748902748902749 COMPASS 0.37537537537537535 COMPASS III 0.0504042504042504 COSMObase 0.0019866019866019865 COSMOconf 0.002541002541002541 COSMOmic 2.772002772002772E-4 COSMOperm 0.001386001386001386 COSMOplex 5.082005082005083E-4 COSMOquick 0.0016632016632016633 COSMOtherm 0.06828366828366829 Cantera 4.62000462000462E-5 Catalyst 0.16525756525756527 Classical Simulations 1.0 Conformers 0.0018018018018018018 Crystallization 0.07872487872487872 DFTB Plus 0.006052206052206052 DMol3 0.22305382305382304 DPD 0.00498960498960499 Discover 0.009378609378609378 Forcite 0.4989142989142989 GULP 0.034141834141834145 Kinetix 1.386001386001386E-4 LUDI 0.00960960960960961 LibDock 0.06925386925386925 LigandFit 0.02032802032802033 MCSS 0.0022176022176022174 MODELER 0.24398244398244398 MesoDyn 0.0026334026334026333 Mesocite 0.00619080619080619 Mesoscale 0.011457611457611457 Modules 0.0 Morphology 0.01917301917301917 ONETEP 0.002263802263802264 Polymorph 0.002356202356202356 QMERA 5.544005544005544E-4 QSAR 0.002079002079002079 Quantum Mechanics 0.6710094710094711 Reflex 0.05714945714945715 Reflex Plus 0.0015246015246015245 Reflex QPA 0.0 Semi-empirical 0.00960960960960961 Sorption 0.050496650496650496 Synthia 0.0012012012012012011 TURBOMOLE 7.392007392007392E-4 VAMP 0.0029106029106029108 Visualization 0.7861861861861862 X-Cell 0.0012936012936012936 ZDOCK 0.031554631554631556

Year

2012 0.0 2013 0.02742847497679129 2014 0.04683939572959744 2015 0.0589079247193856 2016 0.06414043379188117 2017 0.13005316904380115 2018 0.16431766393788505 2019 0.18676681576504348 2020 0.2697274031563845 2021 0.48147522997721326 2022 0.733142037302726 2023 0.8457253776690016 2024 1.0 2025 0.9661574816440206 2026 0.35960840577263903 2027 8.439530762089628E-4

Keywords

target 1.0 potential 0.2034555511204881 visualization 0.1706677310828534 docking 0.16840584668605424 between 0.15599399365151775 analysis 0.14160536769877022 novel 0.09287031229210621 energy 0.07998327345992283 binding 0.058352815951036856 activity 0.05084488034821615 cell 0.050274657391039895 interaction 0.03898424283895003 experimental 0.03750166315029176 synthesized 0.02453859459048488 promising 0.023018000038014862 mechanism 0.01891239474634582 protein 0.014635722567523901 chemical 0.010910265913972364 well 0.007698009921879455 synthesis 0.007469920739008953 design 0.00629145996084469 stability 0.006120393073691813 development 0.005987341050350687 performance 5.892303890821311E-4 effective 0.0
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