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Application

Discovery Studio 1.0 Materials Studio 0.45217140383783005 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05566488614000562 Amorphous Cell 0.1422547090244588 Antibody 0.0 Blends 0.0016868147315153219 CASTEP 0.27748102333427044 CDOCKER 0.36125948833286475 CHARMm 0.41889232499297163 COMPASS 0.23278043294911444 COMPASS III 0.03907787461343829 COSMObase 0.001124543154343548 COSMOconf 2.81135788585887E-4 COSMOperm 2.81135788585887E-4 COSMOplex 0.0 COSMOquick 0.001967950520101209 COSMOtherm 0.03851560303626652 Catalyst 0.28760191172336236 Classical Simulations 0.8777059319651391 Conformers 5.62271577171774E-4 Crystallization 0.05341579983131853 DFTB Plus 0.0033736294630306437 DMol3 0.13916221535001405 DPD 0.002249086308687096 Discover 0.0033736294630306437 Forcite 0.3306156873770031 GULP 0.007871802080404836 LUDI 0.015181332583637897 LibDock 0.12651110486364914 LigandFit 0.02417767781838628 MCSS 0.003654765251616531 MODELER 0.30109642957548494 MesoDyn 0.001124543154343548 Mesocite 0.0033736294630306437 Mesoscale 0.0056227157717177395 Morphology 0.009558616811920157 ONETEP 5.62271577171774E-4 Polymorph 0.0016868147315153219 QMERA 0.0 QSAR 0.0016868147315153219 Quantum Mechanics 0.40905257239246556 Reflex 0.04217036828788305 Reflex Plus 2.81135788585887E-4 Semi-empirical 0.005060444194545966 Sorption 0.019398369412426203 Synthia 2.81135788585887E-4 TURBOMOLE 0.0 VAMP 0.001124543154343548 Visualization 1.0 X-Cell 0.001124543154343548 ZDOCK 0.03739105988192297

Year

2015 0.0 2017 0.06942752740560293 2018 0.12058465286236297 2019 0.1307348761672757 2020 0.25903369874137233 2021 0.3621599675192854 2022 0.46650426309378806 2023 0.6963053187170117 2024 1.0 2025 0.9216402760860739 2026 0.2298010556232237 2027 4.060089321965083E-4

Keywords

novel 1.0 target 0.9664073948822004 docking 0.3201442903843986 potential 0.3155224890091309 visualization 0.22060647052192536 analysis 0.16097396009469056 synthesized 0.14135948596550557 synthesis 0.11734866418667568 activity 0.11723593732386428 binding 0.104723255551798 compound 0.08961785593506932 promising 0.08555968887385865 development 0.07913425769360839 between 0.07428700259271784 design 0.06583248788186224 drug 0.047683462969225564 protein 0.04700710179235712 potent 0.03302897080374253 vitro 0.032803517078119716 inhibition 0.030098072370645924 cell 0.018036298049825275 effective 0.01657084883327697 treatment 0.011949047458009244 interaction 7.890880396798557E-4 stability 0.0
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