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Application

Discovery Studio 0.9202136013821266 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06385896180215475 Amorphous Cell 0.284818805093046 Blends 0.0019588638589618022 CASTEP 0.3416258570029383 CDOCKER 0.1604309500489716 CHARMm 0.2556317335945152 COMPASS 0.34495592556317334 COMPASS III 0.1059745347698335 COSMObase 0.004701273261508325 COSMOconf 0.006072477962781587 COSMOmic 0.0 COSMOperm 3.917727717923604E-4 COSMOplex 1.958863858961802E-4 COSMOquick 0.0011753183153770813 COSMOtherm 0.06699314397649363 Catalyst 0.0761998041136141 Classical Simulations 1.0 Conformers 3.917727717923604E-4 Crystallization 0.07189030362389814 DFTB Plus 0.003525954946131244 DMol3 0.15455435847208618 DPD 0.0021547502448579824 Discover 0.0039177277179236044 Forcite 0.5320274240940255 GULP 0.02056807051909892 Kinetix 1.958863858961802E-4 LUDI 0.0037218413320274243 LibDock 0.06777668952007836 LigandFit 0.0039177277179236044 MCSS 3.917727717923604E-4 MODELER 0.24231145935357493 MesoDyn 7.835455435847208E-4 Mesocite 0.002938295788442703 Mesoscale 0.0056807051909892265 Modules 0.0 Morphology 0.016846229187071498 ONETEP 7.835455435847208E-4 Polymorph 0.001762977473065622 QMERA 1.958863858961802E-4 QSAR 5.876591576885406E-4 Quantum Mechanics 0.4865817825661117 Reflex 0.052105778648383935 Reflex Plus 5.876591576885406E-4 Semi-empirical 0.0050930460333006855 Sorption 0.05621939275220372 Synthia 0.0011753183153770813 TURBOMOLE 1.958863858961802E-4 VAMP 9.794319294809011E-4 Visualization 0.6722820763956905 X-Cell 0.001762977473065622 ZDOCK 0.02742409402546523

Year

2023 0.0 2024 0.40326340326340326 2025 1.0 2026 0.6581196581196581 2027 3.108003108003108E-4

Keywords

target 1.0 potential 0.29877932481403774 analysis 0.2114247568186153 docking 0.2050352851420942 visualization 0.1548731642189586 between 0.15039099752050353 novel 0.09221819568949075 energy 0.08334922754148388 promising 0.08334922754148388 binding 0.06618348273888995 cell 0.06427617776082395 performance 0.045489223726873924 stability 0.04215144001525844 activity 0.04186534426854854 including 0.02183864199885562 effective 0.016975014304787334 experimental 0.016116727064657638 synthesized 0.014686248331108143 enhanced 0.013827961090978447 development 0.01335113484646195 mechanism 0.012397482357428952 interaction 0.009917985885943162 strong 0.009727255388136563 design 0.0029563227160022887 strategy 0.0
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