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Application

Discovery Studio 0.7081422018348624 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06904149834741094 Amorphous Cell 0.3422695556371649 Blends 0.002570694087403599 CASTEP 0.3286816011751744 CDOCKER 0.11604847594564818 CHARMm 0.19720896070510466 COMPASS 0.4171869261843555 COMPASS III 0.08850532500918105 COSMObase 7.344840249724568E-4 COSMOconf 0.0033051781123760557 COSMOmic 0.0 COSMOperm 0.0014689680499449136 COSMOplex 0.0 COSMOquick 3.672420124862284E-4 COSMOtherm 0.05141388174807198 Catalyst 0.05288284979801689 Classical Simulations 1.0 Conformers 3.672420124862284E-4 Crystallization 0.05361733382298935 DFTB Plus 0.005141388174807198 DMol3 0.17113477781858244 DPD 0.0022034520749173708 Discover 0.005141388174807198 Forcite 0.5824458318031582 GULP 0.026808666911494677 LUDI 0.0014689680499449136 LibDock 0.049944913698127064 LigandFit 0.0029379360998898272 MODELER 0.1667278736687477 MesoDyn 0.0011017260374586854 Mesocite 0.003672420124862284 Mesoscale 0.007344840249724568 Modules 0.0 Morphology 0.01836210062431142 ONETEP 0.0014689680499449136 Polymorph 7.344840249724568E-4 QMERA 7.344840249724568E-4 QSAR 0.0011017260374586854 Quantum Mechanics 0.48769739258171135 Reflex 0.033786265148733015 Reflex Plus 0.0 Semi-empirical 0.00697759823723834 Sorption 0.056922511935365405 Synthia 0.0014689680499449136 VAMP 3.672420124862284E-4 Visualization 0.5699596033786265 X-Cell 0.0 ZDOCK 0.03048108703635696

Year

2022 0.08801159000362188 2023 0.17457442955450925 2024 0.6236870699022093 2025 1.0 2026 0.4252082578775806 2027 0.0

Keywords

between 1.0 target 0.9358504398826979 potential 0.23240469208211142 analysis 0.19794721407624633 interaction 0.19006598240469208 docking 0.17980205278592376 energy 0.11711876832844574 visualization 0.11546920821114369 cell 0.08101173020527859 binding 0.07551319648093842 performance 0.059750733137829914 mechanism 0.058834310850439886 experimental 0.05150293255131965 novel 0.05076979472140762 stability 0.04270527859237536 strong 0.020527859237536656 promising 0.012280058651026392 effective 0.009714076246334311 enhanced 0.009714076246334311 amorphous 0.006231671554252199 including 0.0038489736070381232 activity 0.0032991202346041057 higher 0.001466275659824047 surface 0.001466275659824047 protein 0.0
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