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Application

Discovery Studio 1.0 Materials Studio 0.859392575928009 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05167322834645669 Amorphous Cell 0.2706692913385827 Blends 9.84251968503937E-4 CASTEP 0.2770669291338583 CDOCKER 0.1830708661417323 CHARMm 0.29281496062992124 COMPASS 0.3218503937007874 COMPASS III 0.11663385826771654 COSMObase 0.0044291338582677165 COSMOconf 0.007874015748031496 COSMOmic 0.0 COSMOperm 4.921259842519685E-4 COSMOplex 4.921259842519685E-4 COSMOquick 4.921259842519685E-4 COSMOtherm 0.06299212598425197 Catalyst 0.07874015748031496 Classical Simulations 1.0 Conformers 4.921259842519685E-4 Crystallization 0.07529527559055119 DFTB Plus 0.0034448818897637795 DMol3 0.12746062992125984 DPD 0.0014763779527559055 Discover 0.0034448818897637795 Forcite 0.5044291338582677 GULP 0.012303149606299213 Kinetix 0.0 LUDI 0.002952755905511811 LibDock 0.07431102362204725 LigandFit 0.0024606299212598425 MODELER 0.2785433070866142 Mesocite 0.003937007874015748 Mesoscale 0.004921259842519685 Morphology 0.0172244094488189 ONETEP 9.84251968503937E-4 Polymorph 0.001968503937007874 QMERA 0.0 Quantum Mechanics 0.39911417322834647 Reflex 0.054133858267716536 Reflex Plus 0.0 Semi-empirical 0.0044291338582677165 Sorption 0.06348425196850394 Synthia 9.84251968503937E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7480314960629921 X-Cell 4.921259842519685E-4 ZDOCK 0.02952755905511811

Year

2024 0.06884615384615385 2025 1.0 2026 0.9819230769230769 2027 0.0

Keywords

target 1.0 potential 0.33283730158730157 docking 0.25471230158730157 analysis 0.23189484126984128 visualization 0.18551587301587302 between 0.12574404761904762 promising 0.09474206349206349 binding 0.09375 novel 0.09126984126984126 energy 0.05803571428571429 activity 0.057787698412698416 cell 0.05357142857142857 stability 0.042162698412698416 including 0.030753968253968252 strong 0.02703373015873016 performance 0.022321428571428572 effective 0.014384920634920634 therapeutic 0.012896825396825396 development 0.011656746031746032 strategy 0.010168650793650794 mechanism 0.009424603174603174 synthesized 0.006448412698412698 interaction 4.96031746031746E-4 protein 4.96031746031746E-4 enhanced 0.0
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