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Application

Discovery Studio 0.9036170441129119 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0687732342007435 Amorphous Cell 0.28738919073491564 Blends 0.002430654847011724 CASTEP 0.3946239633971976 CDOCKER 0.16013726050900773 CHARMm 0.2406348298541607 COMPASS 0.3744638261366886 COMPASS III 0.08249928510151558 COSMObase 0.0030025736345438946 COSMOconf 0.004718329997140406 COSMOmic 1.4297969688304262E-4 COSMOperm 0.0012868172719473834 COSMOplex 4.2893909064912783E-4 COSMOquick 8.578781812982557E-4 COSMOtherm 0.06734343723191306 Cantera 0.0 Catalyst 0.11395481841578496 Classical Simulations 1.0 Conformers 7.148984844152131E-4 Crystallization 0.07735201601372606 DFTB Plus 0.006434086359736918 DMol3 0.17872462110380327 DPD 0.00328853302830998 Discover 0.004003431512725193 Forcite 0.5498999142121819 GULP 0.021446954532456392 Kinetix 2.8595939376608524E-4 LUDI 0.004003431512725193 LibDock 0.06391192450672005 LigandFit 0.0055762081784386614 MCSS 4.2893909064912783E-4 MODELER 0.17543608807549327 MesoDyn 8.578781812982557E-4 Mesocite 0.004146411209608235 Mesoscale 0.007291964541035173 Morphology 0.01858736059479554 ONETEP 0.0012868172719473834 Polymorph 0.0018587360594795538 QMERA 2.8595939376608524E-4 QSAR 0.001143837575064341 Quantum Mechanics 0.563768944809837 Reflex 0.0560480411781527 Reflex Plus 4.2893909064912783E-4 Semi-empirical 0.008435802116099515 Sorption 0.056334000571918785 Synthia 0.0012868172719473834 TURBOMOLE 5.719187875321705E-4 VAMP 0.0014297969688304261 Visualization 0.7723763225621961 X-Cell 0.0014297969688304261 ZDOCK 0.028738919073491565

Year

2022 0.15513567268077852 2023 0.30529904816025005 2024 0.7525216650092342 2025 1.0 2026 0.5053274612871147 2027 0.0

Keywords

target 1.0 potential 0.26978946694823064 docking 0.2014462148844948 analysis 0.18877583669290332 visualization 0.18544826262238434 between 0.1544762270429385 novel 0.09342804121072502 energy 0.09118832789402956 cell 0.06571958789274973 binding 0.06335189095795739 promising 0.05592884110833813 activity 0.04754591412299226 stability 0.03660331477570871 performance 0.03327574070518974 experimental 0.031036027388494272 synthesized 0.028604338644653483 interaction 0.028284379599411276 mechanism 0.021885198694567096 effective 0.019325526332629423 development 0.015741985025916682 including 0.01529404236257759 synthesis 0.009150828693927178 protein 0.005119344723875344 design 0.0013438279900172777 chemical 0.0
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