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Application

Discovery Studio 0.9973707274320771 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06704304869442484 Amorphous Cell 0.2784050811573747 Blends 0.0017642907551164433 CASTEP 0.3387438249823571 CDOCKER 0.17219477769936486 CHARMm 0.27417078334509526 COMPASS 0.344742413549753 COMPASS III 0.09103740296400847 COSMObase 0.0035285815102328866 COSMOconf 0.005998588567395907 COSMOquick 0.002117148906139732 COSMOtherm 0.06598447424135498 Catalyst 0.07586450247000706 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06774876499647142 DFTB Plus 0.006351446718419196 DMol3 0.14573041637261822 DPD 0.0024700070571630206 Discover 0.002117148906139732 Forcite 0.5321100917431193 GULP 0.022230063514467185 Kinetix 0.0 LUDI 0.0038814396612561752 LibDock 0.07127734650670431 LigandFit 0.0035285815102328866 MODELER 0.26605504587155965 MesoDyn 0.0014114326040931546 Mesocite 0.0017642907551164433 Mesoscale 0.005998588567395907 Modules 0.0 Morphology 0.015525758645024701 ONETEP 3.5285815102328866E-4 Polymorph 0.0014114326040931546 QSAR 7.057163020465773E-4 Quantum Mechanics 0.4745942131263232 Reflex 0.048694424841213835 Reflex Plus 0.001058574453069866 Semi-empirical 0.0077628793225123505 Sorption 0.04940014114326041 Synthia 0.001058574453069866 TURBOMOLE 3.5285815102328866E-4 VAMP 0.001058574453069866 Visualization 0.6792519407198306 X-Cell 0.0017642907551164433 ZDOCK 0.02858151023288638

Year

2025 0.0

Keywords

target 1.0 potential 0.3161300760394758 docking 0.21258696003882868 analysis 0.20627730140753922 between 0.14884322925093027 visualization 0.14819608477592622 novel 0.09739524348810873 promising 0.08995308202556221 binding 0.07911341206924447 energy 0.07765733700048535 cell 0.061640511244135256 activity 0.04740333279404627 stability 0.04384403818152403 including 0.04109367416275683 performance 0.031710079275198186 development 0.022973628862643584 interaction 0.019576120368872352 strong 0.01941433425012134 effective 0.017149328587607184 experimental 0.017149328587607184 synthesized 0.011972172787574826 mechanism 0.010354311600064715 enhanced 0.008574664293803592 therapeutic 0.005500728037534379 protein 0.0
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