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Application

Discovery Studio 1.0 Materials Studio 0.5673709733287149 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07350565428109855 Amorphous Cell 0.17164781906300486 Antibody 0.0 Blends 0.0014135702746365104 CASTEP 0.3770193861066236 CDOCKER 0.19022617124394184 CHARMm 0.3447092084006462 COMPASS 0.260702746365105 COMPASS III 0.03150242326332795 COSMObase 0.0012116316639741518 COSMOconf 0.0016155088852988692 COSMOmic 4.038772213247173E-4 COSMOperm 8.077544426494346E-4 COSMOplex 0.0 COSMOquick 4.038772213247173E-4 COSMOtherm 0.049878836833602586 Catalyst 0.16579159935379645 Classical Simulations 0.8305735056542811 Conformers 0.0014135702746365104 Crystallization 0.03877221324717286 DFTB Plus 0.005048465266558966 DMol3 0.16639741518578352 DPD 0.0012116316639741518 Discover 0.007269789983844911 Forcite 0.32895799676898224 GULP 0.023222940226171242 Kinetix 0.0 LUDI 0.008481421647819063 LibDock 0.08905492730210016 LigandFit 0.02059773828756058 MCSS 0.0014135702746365104 MODELER 0.3301696284329564 MesoDyn 0.0010096930533117932 Mesocite 0.0020193861066235864 Mesoscale 0.004240710823909532 Modules 0.0 Morphology 0.010904684975767368 ONETEP 0.0 Polymorph 0.0012116316639741518 QMERA 2.0193861066235866E-4 QSAR 0.0024232633279483036 Quantum Mechanics 0.531502423263328 Reflex 0.025646203554119548 Reflex Plus 6.058158319870759E-4 Reflex QPA 0.0 Semi-empirical 0.007875605815831988 Sorption 0.02847334410339257 Synthia 4.038772213247173E-4 TURBOMOLE 0.0 VAMP 0.0022213247172859453 Visualization 1.0 X-Cell 0.0014135702746365104 ZDOCK 0.034935379644588045

Year

2010 0.0030358227079538553 2011 0.022161505768063146 2012 0.031876138433515486 2013 0.03764420157862781 2014 0.03642987249544627 2015 0.04978749241044323 2016 0.05494839101396479 2017 0.06587735276259866 2018 0.07316332726168792 2019 0.15027322404371585 2020 0.1894353369763206 2021 0.385853066180935 2022 0.4435336976320583 2023 0.5986642380085003 2024 1.0 2025 0.9359441408621737 2026 0.26806314511232543 2027 0.0

Keywords

analysis 1.0 target 0.9472219949267654 docking 0.3382701906554292 potential 0.3101219212830374 visualization 0.2363963669094182 between 0.16430733982489157 binding 0.1341134113411341 novel 0.09639145732755093 protein 0.08469028721053924 interaction 0.08002618443662549 activity 0.0738073807380738 energy 0.054332705997872516 experimental 0.03927665493822109 including 0.02978479666148433 silico 0.027820963914573275 stability 0.025366172980934458 promising 0.02225677113165862 mechanism 0.021193028393748467 drug 0.01742901562883561 cell 0.016119793797561573 compound 0.013174044677194992 synthesized 0.004173144587185991 treatment 0.0019638327469110547 effective 4.909581867277637E-4 vitro 0.0
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