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Application

Discovery Studio 0.8804420629604822 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0648870636550308 Amorphous Cell 0.2874743326488706 Blends 0.002053388090349076 CASTEP 0.3141683778234086 CDOCKER 0.1540041067761807 CHARMm 0.24229979466119098 COMPASS 0.340041067761807 COMPASS III 0.11334702258726899 COSMObase 0.004106776180698152 COSMOconf 0.006160164271047228 COSMOmic 0.0 COSMOperm 8.213552361396304E-4 COSMOplex 0.0 COSMOquick 4.106776180698152E-4 COSMOtherm 0.06858316221765914 Catalyst 0.07515400410677618 Classical Simulations 1.0 Conformers 4.106776180698152E-4 Crystallization 0.08254620123203285 DFTB Plus 0.0024640657084188913 DMol3 0.14455852156057494 DPD 0.002874743326488706 Discover 0.003696098562628337 Forcite 0.546611909650924 GULP 0.013963039014373716 Kinetix 4.106776180698152E-4 LUDI 0.0032854209445585215 LibDock 0.05831622176591376 LigandFit 0.0024640657084188913 MODELER 0.23039014373716632 Mesocite 0.0032854209445585215 Mesoscale 0.006160164271047228 Morphology 0.02053388090349076 ONETEP 0.0016427104722792608 Polymorph 4.106776180698152E-4 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.45338809034907596 Reflex 0.05913757700205339 Reflex Plus 4.106776180698152E-4 Semi-empirical 0.004517453798767967 Sorption 0.057494866529774126 Synthia 4.106776180698152E-4 TURBOMOLE 0.0 VAMP 0.0012320328542094457 Visualization 0.637782340862423 X-Cell 8.213552361396304E-4 ZDOCK 0.02299794661190965

Year

2024 0.1916046039268788 2025 1.0 2026 0.8733920108327691 2027 0.0

Keywords

target 1.0 potential 0.294303132226193 analysis 0.21589236914021442 docking 0.20348959428211058 visualization 0.1500945974353584 between 0.1406348538995165 promising 0.09018288837502628 novel 0.0815640109312592 energy 0.07799033003994114 cell 0.07000210216523019 binding 0.06832036998108051 performance 0.053815429892789576 stability 0.048139583771284425 activity 0.04246373764977927 enhanced 0.025015766239226404 strong 0.019550136640739964 mechanism 0.018078620979608998 effective 0.015976455749421904 including 0.015766239226403196 synthesized 0.015135589657347067 experimental 0.014084507042253521 strategy 0.013874290519234812 development 0.012402774858103847 design 0.0027328147992432207 interaction 0.0
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