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Application

Discovery Studio 1.0 Materials Studio 0.9596412556053812 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.056928630935851154 Amorphous Cell 0.2715912246598167 Blends 0.0022216051096917524 CASTEP 0.30741460705359624 CDOCKER 0.17633990558178284 CHARMm 0.27908914190502637 COMPASS 0.3310191613440711 COMPASS III 0.11163565676201055 COSMObase 0.004443210219383505 COSMOconf 0.005554012774229381 COSMOmic 0.0 COSMOperm 2.7770063871146905E-4 COSMOplex 2.7770063871146905E-4 COSMOquick 5.554012774229381E-4 COSMOtherm 0.06359344626492641 Catalyst 0.07831158011663426 Classical Simulations 1.0 Conformers 5.554012774229381E-4 Crystallization 0.07247986670369341 DFTB Plus 0.0038878089419605664 DMol3 0.1435712302138295 DPD 0.0027770063871146904 Discover 0.0033324076645376284 Forcite 0.5151346848097751 GULP 0.01721743960011108 Kinetix 2.7770063871146905E-4 LUDI 0.0033324076645376284 LibDock 0.071646764787559 LigandFit 0.004165509580672035 MODELER 0.25576228825326297 MesoDyn 0.0 Mesocite 0.0033324076645376284 Mesoscale 0.00583171341294085 Modules 0.0 Morphology 0.01666203832268814 ONETEP 0.0011108025548458762 Polymorph 0.0022216051096917524 QMERA 2.7770063871146905E-4 QSAR 0.0 Quantum Mechanics 0.44348792002221604 Reflex 0.052207720077756176 Reflex Plus 8.331019161344071E-4 Semi-empirical 0.005276312135517912 Sorption 0.05859483476811997 Synthia 0.0013885031935573452 TURBOMOLE 0.0 VAMP 5.554012774229381E-4 Visualization 0.708692029991669 X-Cell 0.0013885031935573452 ZDOCK 0.02860316578728131

Year

2024 0.2784892554807901 2025 1.0 2026 0.7679617972650314 2027 0.0

Keywords

target 1.0 potential 0.3150178130994793 docking 0.22924088791449712 analysis 0.22197862428062484 visualization 0.16785420663195397 between 0.13990134283365305 promising 0.08933954508084406 novel 0.08892847355439847 binding 0.07344477939161415 energy 0.06782680186352426 cell 0.056864894491641546 activity 0.04905453548917511 stability 0.03987393806522335 performance 0.03507810359002467 including 0.023431077007399288 development 0.015483694162784325 synthesized 0.014935598794190189 effective 0.014113455741298986 strong 0.013976431899150453 mechanism 0.011784050424773911 enhanced 0.009728692792545903 experimental 0.006851192107426692 interaction 0.006166072896684023 strategy 0.002466429158673609 protein 0.0
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