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Application

Discovery Studio 1.0 Materials Studio 0.706476897689769 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07142857142857142 Amorphous Cell 0.23363828289936664 Blends 0.0028149190710767065 CASTEP 0.36980999296270234 CDOCKER 0.20971147079521463 CHARMm 0.33603096410978184 COMPASS 0.3585503166783955 COMPASS III 0.0422237860661506 COSMObase 0.001055594651653765 COSMOconf 3.518648838845883E-4 COSMOmic 3.518648838845883E-4 COSMOperm 0.0014074595355383533 COSMOplex 0.0 COSMOquick 0.001055594651653765 COSMOtherm 0.04996481351161154 Catalyst 0.1414496833216045 Classical Simulations 1.0 Conformers 0.0017593244194229415 Crystallization 0.07776213933849402 DFTB Plus 0.005629838142153413 DMol3 0.17382125263898662 DPD 0.003518648838845883 Discover 0.0014074595355383533 Forcite 0.4676284306826179 GULP 0.029908515130190008 Kinetix 0.0 LUDI 0.003518648838845883 LibDock 0.08937368050668543 LigandFit 0.0063335679099225895 MCSS 0.001055594651653765 MODELER 0.31773399014778325 MesoDyn 0.0028149190710767065 Mesocite 0.0038705137227304713 Mesoscale 0.009148486980999296 Morphology 0.015833919774806474 ONETEP 3.518648838845883E-4 Polymorph 0.001055594651653765 QMERA 0.0 QSAR 3.518648838845883E-4 Quantum Mechanics 0.5323715693173822 Reflex 0.06052076002814919 Semi-empirical 0.00809289232934553 Sorption 0.04468684025334271 Synthia 0.0014074595355383533 TURBOMOLE 7.037297677691766E-4 VAMP 0.0017593244194229415 Visualization 0.9739619985925405 X-Cell 0.0 ZDOCK 0.03518648838845883

Year

2024 0.0

Keywords

target 1.0 potential 0.30313445147099255 docking 0.2690404179268628 visualization 0.2113005224085785 analysis 0.20057739895518284 between 0.14324993126202915 novel 0.10571899917514435 binding 0.09018421776189167 activity 0.06832554302996975 interaction 0.043442397580423425 energy 0.04275501787187242 promising 0.04151773439648061 protein 0.04000549903766841 cell 0.02845751993401155 synthesized 0.0191091558977179 stability 0.01718449271377509 effective 0.01567225735496288 synthesis 0.014847401704701677 mechanism 0.014160021996150674 development 0.011273027220236459 including 0.009073412152873246 experimental 0.00577398955182843 vitro 0.004399230134726423 silico 0.0030244707176244156 compound 0.0
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