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Application

Discovery Studio 0.6319780914261639 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06343891801400943 Amorphous Cell 0.24864531477157584 Antibody 3.5243843341116346E-4 Blends 0.004801973655227103 CASTEP 0.6040354200625578 CDOCKER 0.14987444380809728 CHARMm 0.23093528349266487 COMPASS 0.3790475351337063 COMPASS III 0.04449535221815939 COSMOSim3D 0.0 COSMObase 0.0017621921670558174 COSMOconf 0.0025992334464073306 COSMOmic 6.608220626459316E-4 COSMOperm 0.0010132604960570951 COSMOplex 4.4054804176395435E-4 COSMOquick 0.0014538085378210494 COSMOtherm 0.07802105819639632 Cantera 4.405480417639543E-5 Catalyst 0.13652583814264946 Classical Simulations 1.0 Conformers 0.003039781488171285 Crystallization 0.09520243182519053 DFTB Plus 0.006299836997224547 DMol3 0.320190316754042 DPD 0.009339618485395832 Discover 0.025948279659896913 Forcite 0.47261993920437023 GULP 0.06339486320983304 Kinetix 1.321644125291863E-4 LUDI 0.008943125247808274 LibDock 0.05568527247896383 LigandFit 0.019251949425084805 MCSS 0.002114630600466981 MODELER 0.1997885369399533 MesoDyn 0.0046257544385215205 Mesocite 0.006916604255694084 Mesoscale 0.017754086083087362 Modules 0.0 Morphology 0.022996607780078417 ONETEP 0.004361425613463148 Polymorph 0.004493590025992335 QMERA 5.286576501167452E-4 QSAR 0.003260055509053262 Quantum Mechanics 0.9082338429005683 Reflex 0.06533327459359443 Reflex Plus 0.004317370809286753 Reflex QPA 1.321644125291863E-4 Semi-empirical 0.011189920260804441 Sorption 0.052469271774086966 Synthia 0.001630027754526631 TURBOMOLE 8.810960835279087E-4 VAMP 0.004317370809286753 Visualization 0.6568130754658795 X-Cell 0.003876822767522798 ZDOCK 0.026124498876602495

Year

2007 0.0 2008 7.874704698573804E-4 2009 0.042435908653425496 2010 0.0722722897891329 2011 0.1006212267039986 2012 0.13028261440195993 2013 0.14743197130107621 2014 0.15933152506780995 2015 0.17315600664975064 2016 0.18146819494268965 2017 0.19861755184180593 2018 0.22687899203779857 2019 0.2619651763058885 2020 0.2979263277627089 2021 0.3792982763146382 2022 0.5287426721497944 2023 0.6278764546329513 2024 0.9883629363898854 2025 1.0 2026 0.37256102896141396 2027 6.124770321112959E-4

Keywords

target 1.0 potential 0.1800463380555703 between 0.178083160892096 analysis 0.13135600714525741 visualization 0.12573176986611487 docking 0.12109796430908544 energy 0.11271466723262764 novel 0.0758564581454166 experimental 0.07203622150298014 cell 0.0483719778567765 binding 0.043225270157938485 interaction 0.038556092039405035 activity 0.03243663889920589 chemical 0.0323658937761978 well 0.027749774499920412 synthesized 0.024849224456589023 promising 0.019596399073238888 mechanism 0.018199182893829255 surface 0.014838789550945333 stability 0.012981730071983163 higher 0.006508551316743602 design 0.005182080260342053 synthesis 0.004669178118533453 performance 0.004173962257476876 including 0.0
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