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Application

Discovery Studio 1.0 Materials Studio 0.9699652777777777 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0630533362124811 Amorphous Cell 0.276182250053984 Blends 0.0021593608291945584 CASTEP 0.3247678687108616 CDOCKER 0.1721010580868063 CHARMm 0.276182250053984 COMPASS 0.33383718419347874 COMPASS III 0.10235370330382207 COSMObase 0.004750593824228029 COSMOconf 0.0058302742388253075 COSMOmic 0.0 COSMOperm 4.318721658389117E-4 COSMOplex 2.1593608291945585E-4 COSMOquick 0.0012956164975167351 COSMOtherm 0.06391708054415893 Catalyst 0.08032822284603758 Classical Simulations 1.0 Conformers 4.318721658389117E-4 Crystallization 0.06974735478298423 DFTB Plus 0.0034549773267112936 DMol3 0.15180306629237747 DPD 0.0023752969121140144 Discover 0.004102785575469661 Forcite 0.5171669185920967 GULP 0.01986611962858994 Kinetix 0.0 LUDI 0.004102785575469661 LibDock 0.0723385877780177 LigandFit 0.004318721658389117 MCSS 4.318721658389117E-4 MODELER 0.2602029799179443 MesoDyn 6.478082487583676E-4 Mesocite 0.0030231051608723817 Mesoscale 0.0058302742388253075 Morphology 0.015979270136039732 ONETEP 6.478082487583676E-4 Polymorph 0.0019434247462751025 QMERA 2.1593608291945585E-4 QSAR 6.478082487583676E-4 Quantum Mechanics 0.46771755560354134 Reflex 0.05096091556899158 Reflex Plus 4.318721658389117E-4 Semi-empirical 0.004966529907147485 Sorption 0.05419995681278342 Synthia 8.637443316778234E-4 TURBOMOLE 2.1593608291945585E-4 VAMP 8.637443316778234E-4 Visualization 0.7141006262146404 X-Cell 0.0015115525804361909 ZDOCK 0.030231051608723816

Year

2024 0.4340455588910471 2025 1.0 2026 0.7280593325092707 2027 0.0

Keywords

target 1.0 potential 0.31236306729264474 docking 0.22566510172143975 analysis 0.22044861763171622 visualization 0.16765779864371413 between 0.14783515910276473 novel 0.09525299947835159 promising 0.08586332811684924 binding 0.07511737089201878 energy 0.07125717266562337 cell 0.059885237350026085 activity 0.048930620761606675 stability 0.038184663536776214 performance 0.03275952008346374 including 0.022430881585811163 effective 0.01554512258737611 development 0.014084507042253521 synthesized 0.01366718831507564 strong 0.01189358372456964 mechanism 0.01178925404277517 experimental 0.00792905581637976 interaction 0.00782472613458529 enhanced 0.006885758998435055 protein 0.003755868544600939 design 0.0
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