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Application

Discovery Studio 1.0 Materials Studio 0.05867665418227216 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.006033789219629927 Amorphous Cell 0.02252614641995173 Blends 0.0 CASTEP 0.031375703942075624 CDOCKER 0.23209975864843121 CHARMm 0.37127916331456157 COMPASS 0.04102976669348351 COMPASS III 0.004424778761061947 COSMObase 4.0225261464199515E-4 COSMOconf 0.0 COSMOquick 0.0 COSMOtherm 0.0036202735317779565 Catalyst 0.14883346741753822 Classical Simulations 0.4412711182622687 Crystallization 0.006436041834271922 DFTB Plus 0.0016090104585679806 DMol3 0.01166532582461786 Forcite 0.044650040225261464 GULP 0.0028157683024939663 LUDI 0.004022526146419952 LibDock 0.0997586484312148 LigandFit 0.006838294448913918 MCSS 0.0012067578439259854 MODELER 0.35398230088495575 MesoDyn 0.0 Mesoscale 0.0 Morphology 4.0225261464199515E-4 Polymorph 4.0225261464199515E-4 Quantum Mechanics 0.042236524537409496 Reflex 0.004827031375703942 Semi-empirical 0.0016090104585679806 Sorption 0.006033789219629927 Synthia 4.0225261464199515E-4 TURBOMOLE 0.0 Visualization 1.0 X-Cell 0.0 ZDOCK 0.04022526146419952

Year

2024 0.0

Keywords

target 1.0 docking 0.5335603112840467 potential 0.4153696498054475 visualization 0.3983463035019455 analysis 0.2774805447470817 binding 0.20671206225680933 activity 0.1612354085603113 novel 0.14737354085603113 protein 0.14323929961089493 vitro 0.08657587548638132 silico 0.08463035019455253 between 0.08244163424124513 drug 0.06031128404669261 promising 0.058365758754863814 compound 0.04839494163424125 therapeutic 0.04790856031128405 interaction 0.04353112840466926 synthesis 0.042801556420233464 treatment 0.042801556420233464 inhibition 0.04109922178988327 synthesized 0.013861867704280155 development 0.01240272373540856 potent 0.008025291828793774 modeler 0.005350194552529183 including 0.0
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