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Application

Discovery Studio 0.9811173184357542 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06328223878498102 Amorphous Cell 0.2816762761918155 Blends 0.0016875263675994938 CASTEP 0.35353677401209394 CDOCKER 0.16186190409225143 CHARMm 0.2608634509914217 COMPASS 0.35114611165799464 COMPASS III 0.09576712136127127 COSMObase 0.004078188721698776 COSMOconf 0.005343833497398397 COSMOmic 1.406271972999578E-4 COSMOperm 0.0011250175783996624 COSMOplex 1.406271972999578E-4 COSMOquick 0.0014062719729995782 COSMOtherm 0.0656729011390803 Catalyst 0.09745464772887076 Classical Simulations 1.0 Conformers 2.812543945999156E-4 Crystallization 0.07087610743917874 DFTB Plus 0.005203206300098439 DMol3 0.160033750527352 DPD 0.002250035156799325 Discover 0.003515679932498945 Forcite 0.5373365208831388 GULP 0.01996906201659401 Kinetix 1.406271972999578E-4 LUDI 0.0032344255378990295 LibDock 0.06904795387427928 LigandFit 0.004078188721698776 MCSS 4.2188159189987344E-4 MODELER 0.23526930108282942 MesoDyn 7.031359864997891E-4 Mesocite 0.0026719167486991984 Mesoscale 0.005343833497398397 Modules 0.0 Morphology 0.017015890873294894 ONETEP 8.437631837997469E-4 Polymorph 0.0018281535648994515 QMERA 1.406271972999578E-4 QSAR 8.437631837997469E-4 Quantum Mechanics 0.503585993531149 Reflex 0.05104767261988469 Reflex Plus 0.0012656447756996202 Semi-empirical 0.006750105470397975 Sorption 0.05596962452538321 Synthia 0.0014062719729995782 TURBOMOLE 4.2188159189987344E-4 VAMP 0.0011250175783996624 Visualization 0.7501054703979749 X-Cell 0.001546899170299536 ZDOCK 0.027422303473491772

Year

2023 0.1033739355395063 2024 0.5023175595558909 2025 1.0 2026 0.4580144443246739 2027 0.0

Keywords

target 1.0 potential 0.29350498123948765 docking 0.2169103376892224 analysis 0.20481304179065857 visualization 0.18023030146202615 between 0.15293052141286065 novel 0.09956009833096131 energy 0.08435761418035968 promising 0.07342476387631 binding 0.07180747832837366 cell 0.06449734765170138 activity 0.05110622331478846 stability 0.040496830120326045 performance 0.03467460214775521 interaction 0.02296545478069608 synthesized 0.022771380514943717 experimental 0.022383231983438997 including 0.021154094967007375 effective 0.01953680941907103 development 0.01746668391771251 mechanism 0.016884461120455427 protein 0.0095096390218657 enhanced 0.005369388019148661 synthesis 0.0039461767369646785 design 0.0
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