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Application

Discovery Studio 1.0 Materials Studio 0.20776439089692103 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.02437785678009142 Amorphous Cell 0.07770441848654139 Blends 0.0 CASTEP 0.11681056373793804 CDOCKER 0.2346368715083799 CHARMm 0.3727780599288979 COMPASS 0.12188928390045708 COMPASS III 0.010665312341289994 COSMOconf 5.078720162519045E-4 COSMOquick 0.0 COSMOtherm 0.016251904520060943 Catalyst 0.14321990858303707 Classical Simulations 0.5972574911122397 Crystallization 0.023362112747587607 DFTB Plus 0.0035551041137633316 DMol3 0.05180294565769426 DPD 5.078720162519045E-4 Forcite 0.1564245810055866 GULP 0.009141696292534281 LUDI 0.0045708481462671405 LibDock 0.09801929913661757 LigandFit 0.006602336211274758 MCSS 0.0015236160487557136 MODELER 0.33925850685627224 MesoDyn 0.0 Mesocite 0.0 Mesoscale 0.001015744032503809 Morphology 0.006094464195022855 ONETEP 0.0 Polymorph 5.078720162519045E-4 QSAR 0.0 Quantum Mechanics 0.1670898933468766 Reflex 0.01574403250380904 Semi-empirical 0.0045708481462671405 Sorption 0.013204672422549517 Synthia 5.078720162519045E-4 TURBOMOLE 5.078720162519045E-4 VAMP 5.078720162519045E-4 Visualization 1.0 ZDOCK 0.04164550533265617

Year

2024 0.0

Keywords

target 1.0 docking 0.44368600682593856 potential 0.3938041480703597 visualization 0.33237070097138355 analysis 0.24940929377789445 binding 0.16933578367025465 activity 0.13809398792333946 novel 0.13441848254134944 protein 0.10816487266999213 between 0.1034392228931478 vitro 0.06773431346810187 promising 0.06274612759254397 silico 0.06143344709897611 interaction 0.04541874507744815 synthesis 0.04226831189288527 compound 0.04148070359674455 drug 0.04069309530060383 therapeutic 0.034917301128905225 treatment 0.03229194014176949 synthesized 0.025728537673930164 inhibition 0.02284064058808086 development 0.01785245471252297 effective 0.01338934103439223 including 0.011026516145970071 mechanism 0.0
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