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Application

Discovery Studio 1.0 Materials Studio 0.21355567509413664 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.022457067371202115 Amorphous Cell 0.07001321003963012 CASTEP 0.19418758256274768 CDOCKER 0.3989431968295905 CHARMm 0.5151915455746368 COMPASS 0.11624834874504623 COSMOtherm 0.019815059445178335 Catalyst 0.5270805812417437 Classical Simulations 0.7490092470277411 Conformers 0.001321003963011889 Crystallization 0.05812417437252312 DFTB Plus 0.0 DMol3 0.10171730515191546 DPD 0.003963011889035667 Discover 0.01453104359313078 Forcite 0.12681638044914134 GULP 0.018494055482166448 LUDI 0.017173051519154558 LibDock 0.15323645970937913 LigandFit 0.05548216644649934 MCSS 0.005284015852047556 MODELER 0.6578599735799208 MesoDyn 0.0 Mesocite 0.002642007926023778 Mesoscale 0.0066050198150594455 Morphology 0.017173051519154558 ONETEP 0.0 Quantum Mechanics 0.2919418758256275 Reflex 0.03830911492734478 Reflex Plus 0.003963011889035667 Semi-empirical 0.001321003963011889 Sorption 0.01453104359313078 VAMP 0.0 Visualization 1.0 X-Cell 0.001321003963011889 ZDOCK 0.062087186261558784

Year

2019 0.0

Keywords

target 1.0 docking 0.2908616187989556 visualization 0.21618798955613577 potential 0.17284595300261096 activity 0.15300261096605744 novel 0.12010443864229765 binding 0.11279373368146214 protein 0.10861618798955613 analysis 0.09869451697127937 between 0.0825065274151436 modeler 0.0804177545691906 inhibition 0.05065274151436031 interaction 0.04647519582245431 catalyst 0.04543080939947781 synthesized 0.03968668407310705 compound 0.0391644908616188 vitro 0.038642297650130546 synthesis 0.031331592689295036 drug 0.02610966057441253 cell 0.012010443864229765 human 0.010443864229765013 mechanism 0.004699738903394256 potent 0.004699738903394256 design 0.0036553524804177544 well 0.0
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